카프릴로일 염화물

Octanoyl chloride

HCID 8124CAS 111-64-8

기본 정보

표준 SMILES
CCCCCCCC(=O)Cl
InChIKey
REEZZSHJLXOIHL-UHFFFAOYSA-N
분자식
C8H15ClO
평균 분자량
162.66 g/mol
단동위원소 질량
162.08114278

개요

Caprylyl chloride is a clear colorless to straw-colored liquid with a pungent odor. (NTP, 1992)

이름 및 식별자

우선 이름
Octanoyl chloride
IUPAC
octanoyl chloride
현지명
카프릴로일 염화물
영어명
Octanoyl chloride
분자식
C8H15ClO
분자량
162.66

이름 및 동의어

Octanoyl chloride111-64-8Capryloyl chlorideCAPRYLYL CHLORIDEn-Octanoyl chlorideCaprylic acid chlorideOctanoic acid chlorideOctanoic chlorideMFCD00000766DTXSID9024724BK8FUS6OVToctanoylchloride
이름 더 보기
카프릴로일염화물카프릴로일염화물옥타노일 클로라이드옥타노일클로라이드OctanoyLOctanoyl chloridOTCLXin chlorideCaprylyl chloridoctanoicchloriden-Caprylchloride
CCRIS 5990EINECS 203-891-6BRN 0635917caprylic chlorideoctanoyl- chlorideUNII-BK8FUS6OVTC7H15COClOctanoyl chloride, 99%

데이터베이스 식별자

CAS
111-64-8
PubChem CID
8124
DTXSID
DTXSID9024724
ChEMBL
CHEMBL1504663
UNII
BK8FUS6OVT
EC Number
203-891-6
Nikkaji
J95.913H

물성

구조 계산 물성

XLogP
4
극성 표면적
17.1 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
6
무거운 원자 수
10

실험 및 물리화학적 성질

Chemical Classes · 2건

Toxic Gases & Vapors -> Acid Halides

Corrosives

SpringerMaterials PropertiesBoiling point
Density · 2건

0.973 at 46 °F (NTP, 1992) - Less dense than water; will float

0.9535 @15°C

Solubilityless than 1 mg/mL at 70 °F (NTP, 1992)
Flash Point · 2건

177 °F (NTP, 1992)

177 °F

Boiling Point · 2건

385 °F at 760 mmHg (NTP, 1992)

195.6 °C @760 [mm Hg]

물리화학적 성질

녹는점
-63 °C · -63 °C
끓는 점
195 °C · 195 °C (lit.)
밀도
0.953 g/mL · 0.953 g/mL at 25 °C (lit.)
증기압
2.5 mm · 2.5 mm Hg ( 20 °C)
굴절률
20 · n20/D 1.435(lit.)
인화점
177 °F · 177 °F

화학적 성질

clear liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H290 (96.4%): May be corrosive to metals [Warning Corrosive to Metals]

P234, P260, P261, P264, P264+P265, P271, P272, P280, P284, P302+P352, P304+P340, P305+P354+P338, P316, P317, P320, P321, P332+P317, P333+P317, P362+P364, P390, P403+P233, P405, P406, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 167 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Octanoyl chloride

Status: Active Update: 10-11-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/13360

Octanoyl chloride: 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.)

Other Safety InformationIMAP assessments - Octanoyl chloride: Human health tier I assessment
DOT LabelCorrosive
Fire HazardsThis chemical is combustible. (NTP, 1992)
Health Hazards · 1건

SYMPTOMS: Symptoms of exposure to this compound may include eye and skin irritation. Inhalation may be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis and pulmonary edema. Other symptoms include a burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, vomiting and lacrimation. This compound is extremely destructive to tissue of the mucous membranes, upper respiratory tract, eyes and skin.

Hazards SummaryA severe skin, eye, mucous membrane, and respiratory tract irritant; A lachrymator; [CAMEO] Inhalation may cause chemical pneumonitis and pulmonary edema; [CAMEO] Corrosive; Harmful if swallowed; [MSDSonline]

안전 및 보호

Fire FightingFires involving this material can be controlled with a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
First Aid · 1건

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 1건

SMALL SPILLS AND LEAKAGE: If you should spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION, then use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with acetone followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Protective Action Criteria (PAC) · 3건

1.2 [mg/m3]

13 [mg/m3]

79 [mg/m3]

Personal Protective Equipment (PPE)MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves.

독성 정보

Adverse EffectsDermatotoxin - Skin burns.

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
RH1570000
ridadr
UN 3265 8/PG 2
HS 번호
29159080
risk_code
34-22-43-41-38-23

화학 및 산업

용도 및 제조

UsesUsed to make other organic chemicals; [Hawley]
General Manufacturing InformationOctanoyl chloride: ACTIVE

응용 분야

용도Octanoyl chloride is used to produce adhesives. It is used as an acylating agent for a variety of compounds such as sugars (e.g. Sucrose, aromatic compounds (e.g. Anisole and monoglycerides.

일반 설명Clear colorless to straw-colored liquid with a pungent odor.

제조 방법 · 1건

Diphosgene (108.8 g) was added to a mixture of octanoic acid (144.2 g) and DMF (1.5 L) at 70 C°. The mixture was left to stand for 1 h, and then nitrogen was bubbled through it for 30 min at 100 C° to give 96.9% of octanoyl chloride (purity 99.99%). Benzoyl chloride and terephthaloyl chloride were similarly prepared.

공급사50 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]

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