Phenyl phosphorus dichloride

HCID 12573

Basic information

CAS
644-97-3
Standard SMILES
ClP(Cl)c1ccccc1
InChIKey
IMDXZWRLUZPMDH-UHFFFAOYSA-N
Molecular formula
C6H5Cl2P
Average molar mass
178.98 g/mol
Monoisotopic mass
177.95059215

Overview

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

Names & identifiers

Preferred name
Phenyl phosphorus dichloride
IUPAC
dichloro(phenyl)phosphane
English name
Dichlorophenylphosphine
Molecular formula
C6H5Cl2P
Molecular weight
178.98

Names & synonyms

Dichlorophenylphosphine644-97-3PhenyldichlorophosphinePhenylphosphonous dichlorideDichloro(phenyl)phosphineBenzenephosphonous dichloridePhenylphosphine dichloridePhosphonous dichloride, phenyl-PHENYL PHOSPHORUS DICHLORIDEBenzene phosphorus dichloridePhenylphosphorus dichloridePhosphine, dichlorophenyl-
Show more names
BPDPhPCl2Dichlorophenylphosphine,97%AURORA KA-1275Phenylphosphonous diDichiorophenylphosphine
Phenylphosphonous acid dichlorideBenzenephosphorus dichloridePhosphonous dichloride, P-phenyl-NSC 66478DTXSID4027282HSDB 2729Benzene phosphorus dichloride (DOT)EINECS 211-425-8

Database identifiers

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

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
9

Experimental & physicochemical properties

Chemical Classes · 2 items

Other Classes -> Phosphorus Compounds

Corrosives

SpringerMaterials PropertiesSchoenflies notation
Odoracrid, pungent
Density · 2 items

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

1.356 @ 20 °C/4 °C

Color/FormCOLORLESS LIQUID
Solubility · 2 items

SOL IN COMMON INERT ORGANIC SOLVENTS

MISCIBLE WITH BENZENE, CARBON DISULFIDE

Physicochemical properties

Melting point
51 °C · −51 °C(lit.)
Boiling point
222 °C759 · 222 °C759 mm Hg(lit.)
Density
1.319 g/mL · 1.319 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.597(lit.)
Flash point
230 °F · >230 °F
storage temp.
30 °C · Store below +30°C.

Safety & regulation

GHS classification

GHS Classification · 6 items

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

Hazard information

Regulatory Information · 4 items

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 items

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 items

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)

· 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 item

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]

Safety & protection

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

· 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 items

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 items

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

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

Fire Fighting ProceduresLarge amounts of water.

Toxicology

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 items

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/

Safety data

F
10-21
wgk
3
tsca
TSCA listed
rtecs
TB2478000
ridadr
UN 2798
hs_code
29310095

Chemistry & industry

Uses & manufacturing

Uses · 3 items

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 items

(1977) No Data

(1979) No Data

U.S. Imports · 2 items

(1977) No Data

(1979) No Data

U.S. Production · 2 items

(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
Applications · 3 items

UsesOrganic synthesis, for derivation of plasticizers, polymers, antioxidants; oil additives.

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

General DescriptionA colorless, fuming liquid. Density 1.32 g / cm3. Flash point 102°C. Corrosive to metals and tissue.

Related reactions

78 records

Compound notes

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