4-Chlorophenylacetyl chloride

HCID 90692CAS 25026-34-0

기본 정보

표준 SMILES: O=C(Cl)Cc1ccc(Cl)cc1
InChIKey: UMQUIRYNOVNYPA-UHFFFAOYSA-N
분자식: C8H6Cl2O
평균 분자량: 189.04 g/mol
단동위원소 질량: 187.97957017

이름 및 식별자

우선 이름: 4-Chlorophenylacetyl chloride
IUPAC: 2-(4-chlorophenyl)acetyl chloride
영어명: 4-Chlorobenzeneacetyl chloride
분자식: C8H6Cl2O
분자량: 189.04

이름 및 동의어

4-Chlorophenylacetyl chloride25026-34-04-Chlorobenzeneacetyl chlorideEINECS 246-571-1DTXSID10179736RefChem:522047DTXCID70102227246-571-12-(4-chlorophenyl)acetyl chloridep-Chlorophenylacetyl chlorideMFCD00037111Benzeneacetyl chloride, 4-chloro-

이름 더 보기

SKL1311TIMTEC-BB SBB0058594-chlorophenyl chloride4-chlorophenylacethyl chlorideparachlorobenzenethylacylchloro4-Chlorophenylacetyl chloride 97%

(4-chlorophenyl)acetyl chloride4-chlorophenylacetic acid chloride4-Chlorophenylacetylchloride4-chlorobenzenacetyl chlorideSCHEMBL76050p-chlorophenyl-acetyl chloride(4-chlorophenyl)acetylchloride4-chloro-phenylacetyl chloride

데이터베이스 식별자

CAS: 25026-34-0
PubChem CID: 90692
DTXSID: DTXSID10179736
EC Number: 246-571-1
Nikkaji: J236.033K

물성

구조 계산 물성

XLogP: 3.1
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 139

물리화학적 성질

끓는 점: 85 °C1 · 85 °C1 mm Hg(lit.)
밀도: 1.292 g/mL · 1.292 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.5510(lit.)
인화점: 230 °F · >230 °F
저장 조건: 2 · Storage temp. 2-8°C
물리적 상태: 액체
색상: 투명한 노란색에서 갈색까지
BRN: 637775 · 637775
InChI: 1S/C8H6Cl2O/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2
InChIKey: UMQUIRYNOVNYPA-UHFFFAOYSA-N
SMILES: ClC(=O)Cc1ccc(Cl)cc1
NIST: p-Chlorophenylacetyl chloride(25026-34-0)

화학적 성질

clear yellow to brown liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (97.9%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P270, P272, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P362+P364, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (97.9%)

안전 데이터

wgk: 3
ridadr: UN 3265 8/PG 2
HS 번호: 29163990
risk_code: 22-34-43
hazard_code: C
safety_code: 26-36/37/39-45-24/25
포장분류: II
위험 등급: 8
Hazard Classifications: Acute Tox. 4 OralEye Dam. 1Skin Corr. 1BSkin Sens. 1
스토리지 클래스: 8A - Combustible corrosive hazardous materials