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ジクロロフェニルホスフィン

Phenyl phosphorus dichloride

HCID 12573
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基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
644-97-3
標準SMILES
ClP(Cl)c1ccccc1
InChIKey
IMDXZWRLUZPMDH-UHFFFAOYSA-N
分子式
C6H5Cl2P
平均分子量
178.98 g/mol
単同位体質量
177.95059215

概要

Benzene phosphorus dichloride appears as a colorless, fuming liquid. Density 1.32 g / cm3. Flash point 102 °C. Corrosive to metals and tissue.

名称と識別子

優先名称
Phenyl phosphorus dichloride
IUPAC
dichloro(phenyl)phosphane
現地名
ジクロロフェニルホスフィン
英語名
Dichlorophenylphosphine
分子式
C6H5Cl2P
分子量
178.98

名称と別名

Dichlorophenylphosphine644-97-3PhenyldichlorophosphinePhenylphosphonous dichlorideDichloro(phenyl)phosphineBenzenephosphonous dichloridePhenylphosphine dichloridePhosphonous dichloride, phenyl-PHENYL PHOSPHORUS DICHLORIDEBenzene phosphorus dichloridePhenylphosphorus dichloridePhosphine, dichlorophenyl-
名称をさらに表示
ジクロロフェニルホスフィンフェニルジクロロホスフィンジクロロ(フェニル)ホスフィンホスフェニルクロリドジクロロ（フェニル）ホスファンP,P-ジクロロフェニルホスフィンフェニルジクロロホスフィン, 97%フェニルジクロロホスフィン, 99%BPDPhPCl2Dichlorophenylphosphine,97%AURORA KA-1275Phenylphosphonous diDichiorophenylphosphine
Phenylphosphonous acid dichlorideBenzenephosphorus dichloridePhosphonous dichloride, P-phenyl-NSC 66478DTXSID4027282HSDB 2729Benzene phosphorus dichloride (DOT)EINECS 211-425-8

データベース識別子

CAS
644-97-3
PubChem CID
12573
DTXSID
DTXSID4027282
ChEMBL
CHEMBL1899635
UNII
WRU258L1EW
EC Number
211-425-8
Nikkaji
J34.568G

物性

構造計算による物性補完中

XLogP
3.1
極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
0
回転可能結合数
0
重原子数
9
形式電荷
0
複雑度
79.1

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Phosphorus Compounds

Corrosives

SpringerMaterials PropertiesSchoenflies notation
Odoracrid, pungent
Density · 2 件

1.14 at 77 °F (USCG, 1999) - Denser than water; will sink

1.356 @ 20 °C/4 °C

Color/FormCOLORLESS LIQUID
Solubility · 2 件

SOL IN COMMON INERT ORGANIC SOLVENTS

MISCIBLE WITH BENZENE, CARBON DISULFIDE

CorrosivityCorrodes metal, except 316 stainless steel, nickel, or Hastelloy
Flash Point · 2 件

215 °F (USCG, 1999)

215 °F OC May be lower because of presence of dissolved phosphorus

Boiling Point · 2 件

430 °F at 760 mmHg (USCG, 1999)

224.6 °C @ 760 MM HG; 99-101 °C @ 11 MM HG

Melting Point · 2 件

-60 °F (USCG, 1999)

安全と法規制

安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 1.2% (2 of 171) of reports.

Danger

H290 (63.2%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P363, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 171 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

危険有害性情報

Regulatory Information · 4 件

Chemical: Phosphonous dichloride, phenyl-

Status: Active Update: 27-11-2017 https://echa.europa.eu/registration-dossier/-/registered-dossier/5488

Dichlorophenylphosphine: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelCorrosive
Fire Hazards · 3 件

Special Hazards of Combustion Products: Toxic fumes include oxides of phosphorus and hydrogen chloride.

· EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily.

· EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily.

Fire PotentialFLAMMABLE.
Health Hazards · 3 件

Inhalation causes irritation of nose and throat; pulmonary edema may develop following severe exposures. Contact with skin or eyes causes severe burns. Ingestion causes severe burns of mouth and stomach. (USCG, 1999)

化学と産業

用途と製造

Uses · 3 件

Used in oil additives and in the production of plasticizers, polymers, and antioxidants; [HSDB]

ORGANIC SYNTHESIS; FOR DERIVATION OF PLASTICIZERS, POLYMERS, ANTIOXIDANTS; OIL ADDITIVES

CHEM INT, EG, FOR DICHLOROPHENYLPHOSPHINE OXIDE

U.S. Exports · 2 件

(1977) No Data

(1979) No Data

U.S. Imports · 2 件

(1977) No Data

(1979) No Data

U.S. Production · 2 件

(1977) PROBABLY GREATER THAN 2.27X10+6 GRAMS

(1979) PROBABLY GREATER THAN 2.27X10+6 GRAMS

Methods of ManufacturingPROBABLY BY REACTION OF A GRIGNARD REAGENT WITH PHOSPHOROUS TRICHLORIDE
General Manufacturing InformationPhosphonous dichloride, P-phenyl-: ACTIVE
応用分野 · 3 件

用途可塑剤、ポリマー、酸化防止剤、油添加剤等の有機合成原料

使用Dichlorophenylphosphine and its derivatives are used as an intermediate to make plasticizers, antioxidants, stabilizers, catalysts and high pressure lubricant additives and in lacquer formulatings.

一般的な説明A colorless, fuming liquid. Density 1.32 g / cm3. Flash point 102°C. Corrosive to metals and tissue.

調製方法 · 2 件

合成方法PCl3とベンゼンのFriedel-Crafts反応から合成

純化方法Distil it in a vacuum byfractionating through a 20cm column packed with glass helices (better use a spinning band column) [Buchner & Lockhart J Am Chem Soc 73 755 1951, NMR: Müller et al. J Am Chem Soc 78 3557 1956, IR: Daasch & Smith Anal Chem 23 853 1951]. It forms a yellow Ni complex: Ni(C6H5Cl2P)4 (m 91-92o, from H2O) [Quin J Am Chem Soc 79 3681 1957 ] and a yellow complex with molybdenum carbonyl: Mo(CO)3.(C6H5Cl2P)3 (m 106-110o dec) [Abel et al. J Chem Soc 2323 1959]. [Beilstein 16 IV 972.]

関連反応

78 件
反応記録を作成
HRID 94839 の反応式
HRID 94839反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 121499 の反応式
HRID 121499反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 170559 の反応式
HRID 170559反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 212699 の反応式
HRID 212699反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 224542 の反応式
HRID 224542反応物としてuspto-grants-1980_11
HRID 247535 の反応式
HRID 247535反応物としてuspto-grants-1987_11
HRID 247536 の反応式
HRID 247536反応物としてuspto-grants-1987_11
HRID 267858 の反応式
HRID 267858反応物としてuspto-grants-1976_03
1 / 10 ページ

化合物ノート

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このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
その他の操作
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-51 °C

Surface Tensionest 25 dynes/cm= 0.025 N/m @ 20 °C
Refractive Index · 2 件

INDEX OF REFRACTION: 1.5958 @ 25 °C/D

INDEX OF REFRACTION: 1.6030 @ 20 °C/D

物理化学的性質

融点
51 °C · −51 °C(lit.)
沸点
222 °C759 · 222 °C759 mm Hg(lit.)
比重(密度)
1.319 g/mL · 1.319 g/mL at 25 °C(lit.)
屈折率
20 · n20/D 1.597(lit.)
闪点
230 °F · >230 °F
貯蔵温度
30 °C · Store below +30°C.
外見
液体
比重
1.319 · 1.319 (20℃)
色
無色透明～微黄色透明
水溶解度
反応する
BRN
508189 · 508189
Henry's Law Constant
6.5 · 6.5×10-1 mol/(m3Pa) at 25℃, Zhang et al. (2010)
CAS データベース
644 · 644-97-3(CAS DataBase Reference)
NISTの化学物質情報
Phosphonous dichloride, phenyl-(644-97-3)
EPAの化学物質情報
Phosphonous dichloride, P-phenyl- (644-97-3)

化学的性質

化学的特性Colorless to light yellow liqui

化学性质他のリン化合物合成の重要な原料

· CORROSIVE and/or TOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.

· CORROSIVE and/or TOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death.

Hazards Summary · 1 件

Corrosive to skin and tissue; Emergency treatment: Acids; [HSDB] Reacts with moisture producing hydrogen chloride and heat; May cause severe burns to skin and eyes; Inhalation of high concentrations may cause pulmonary edema; [CAMEO] Causes convulsions in mice after lethal doses; [RTECS] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause chemical pneumonitis; [MSDSonline]

DOT ID and Guide · 2 件

2798 137

2798 137

Reactive GroupAcyl Halides, Sulfonyl Halides, and Chloroformates
Reactivity AlertsWater-Reactive
Reactivity Profile · 1 件

BENZENE PHOSPHORUS DICHLORIDE is incompatible with water, with bases (including amines), with strong oxidizing agents, and with alcohols. May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].

DOT Emergency Guidelines · 5 件

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Fire or Explosion: EXCEPT FOR ACETIC ANHYDRIDE (UN1715), THAT IS FLAMMABLE, some of these materials may burn, but none ignite readily. May ignite combustibles (wood, paper, oil, clothing, etc.). Substance will react with water (some violently), releasing corrosive and/or toxic gases and runoff. Flammable/toxic gases may accumulate in confined areas (basement, tanks, hopper/tank cars, etc.). Contact with metals may evolve flammable hydrogen gas. Containers may explode when heated or if contaminated with water. Substance may be transported in a molten form.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Health: CORROSIVE and/or TOXIC; inhalation, ingestion or contact (skin, eyes) with vapors, dusts or substance may cause severe injury, burns or death. Fire will produce irritating, corrosive and/or toxic gases. Reaction with water may generate much heat that will increase the concentration of fumes in the air. Contact with molten substance may cause severe burns to skin and eyes. Runoff from fire control or dilution water may cause pollution.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Public Safety: CALL Emergency Response Telephone Number on Shipping Paper first. If Shipping Paper not available or no answer, refer to appropriate telephone number listed on the inside back cover. As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids. Keep unauthorized personnel away. Stay upwind. Keep out of low areas. Ventilate enclosed areas.

/GUIDE 137: SUBSTANCES - WATER-REACTIVE - CORROSIVE/ Protective Clothing: Wear positive pressure self-contained breathing apparatus (SCBA). Wear chemical protective clothing that is specifically recommended by the manufacturer. It may provide little or no thermal protection. Structural firefighters' protective clothing provides limited protection in fire situations ONLY; it is not effective in spill situations where direct contact with the substance is possible.

For more DOT Emergency Guidelines (Complete) data for PHENYL PHOSPHORUS DICHLORIDE (8 total), please visit the HSDB record page.

DOT Hazard Classification · 4 件

Phenyl phosphorus dichloride

UN2798

Class 8 Corrosive material (49 eCFR § 173.136)

PG II: the degree of danger presented by the material is medium

安全と保護具

Fire FightingExcerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:
Accidental Release Measures · 4 件

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· Do not touch damaged containers or spilled material unless wearing appropriate protective clothing.

First Aid · 3 件

Get medical attention following all exposures to this compound.

General First Aid:

General First Aid:

Firefighting HazardsContainers may rupture. Hot liquid is spontaneously flammable because of presence of dissolved phosphorus.
Exposure Control and Personal Protection · 2 件

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Fire Fighting ProceduresLarge amounts of water.
Nonfire Spill ResponseExcerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:
Isolation and Evacuation · 3 件

Excerpt from ERG Guide 137 [Substances - Water-Reactive - Corrosive]:

Immediate precautionary measure

Immediate precautionary measure

Personal Protective Equipment (PPE) · 2 件

Self-contained breathing apparatus; acid-type canister mask; goggles and face shield; rubber gloves; protective clothing. (USCG, 1999)

Self-contained breathing apparatus; acid-type canister mask; goggles & face shield; rubber gloves; protective clothing.

Emergency Response Planning Guidelines · 2 件

· When material is not involved in fire, do not use water on material itself.

· When material is not involved in fire, do not use water on material itself.

毒性情報

Adverse EffectsDermatotoxin - Skin burns.
Human Toxicity ExcerptsHIGH IRRITANT TO SKIN, EYES & MUCOUS MEMBRANES & VIA ORAL & INHALATION ROUTES. HIGH= CAPABLE OF CAUSING DEATH OR PERMANENT INJURY DUE TO EXPOSURES OF NORMAL USE; INCAPACITATING & POISONOUS...
Non-Human Toxicity Excerpts · 2 件

SYMPTOMATOLOGY (...INGESTION OR SKIN CONTACT): 1. CORROSION OF MUCOUS MEMBRANES OF MOUTH, THROAT AND ESOPHAGUS, WITH IMMEDIATE PAIN AND DYSPHAGIA. NECROTIC AREAS...GRAYISH WHITE BUT SOON ACQUIRE A BLACKISH DISCOLORATION (YELLOW IN CASE OF NITRIC ACID) & SOMETIMES SHRUNKEN OR WRINKLED TEXTURE... 2. EPIGASTRIC PAIN...MAY BE ASSOC WITH NAUSEA & VOMITING... AT TIMES, GASTRIC HEMORRHAGE MAY BE INTENSE, AND VOMITUS THEN CONTAINS FRESH BLOOD. PROFOUND THIRST. 3. ULCERATION OF ALL MEMBRANES AND TISSUES WITH WHICH THE ACID COMES IN CONTACT. AFTER THE INGESTION OF CONCN MINERAL ACID, THIS CORROSION MAY LEAD WITHIN A FEW HR OR A FEW DAYS TO GASTRIC PERFORATION AND PERITONITIS. 4. CIRCULATORY COLLAPSE WITH CLAMMY SKIN, WEAK & RAPID PULSE, SHALLOW RESP, AND SCANTY URINE. CIRCULATORY EDEMA. /ACIDS/

SYMPTOMATOLOGY.../INGESTION/: 6. LATE ESOPHAGEAL, GASTRIC & PYLORIC STRICTURES & STENOSES, WHICH MAY REQUIRE MAJOR SURGICAL REPAIR, SHOULD BE ANTICIPATED. SIGNS OF OBSTRUCTION COMMONLY APPEAR WITHIN A FEW WK BUT MAY BE DELAYED FOR MONTHS AND EVEN YEARS. PERMANENT SCARS MAY ALSO APPEAR IN THE CORNEA, SKIN AND OROPHARYNX. 7. UNCORRECTED CIRCULATORY COLLAPSE OF SEVERAL HR...MAY LEAD TO RENAL FAILURE & ISCHEMIC LESIONS IN LIVER & HEART. /ACIDS/

安全データ

F
10-21
wgk
3
tsca
TSCA listed
rtecs
TB2478000
ridadr
UN 2798
hs_code
29310095
risk_code
17-25-34-29-37-35-14
化審法
(3)-2517
消防法
危-4-3-III
hazard_code
F,T
safety_code
26-28-36/37/39-43-45-28A
hazard_class
8
packing_group
II
有毒物質データの
644-97-3(Hazardous Substances Data)

上流・下流製品情報

下流製品

(R,R)-1,2-ビス[(2-メトキシフェニル)フェニルホスフィノ]エタン1 1'-Bis(diphenylphosphino)ferroceneジシクロヘキシルフェニルホスフィンイソプロピルジフェニルホスフィンフェニルホスフィンジエチルフェニルホスフィン​ペンタカルボニル鉄2-カルボキシエチル(フェニル)ホスフィン酸2,5-ジクロロ-2,5-ジメチルヘキサン3-メチル-1-フェニル-2-ホスホレン1-オキシドビス(1,1-ジメチルエチル)フェニルホスフィンゲルマニウム(IV)テトラクロリド