Benzeneacetyl chloride, 4-bromo-

HCID 181552CAS 37859-24-8

기본 정보

표준 SMILES: O=C(Cl)Cc1ccc(Br)cc1
InChIKey: VQVBNWUUKLBHGI-UHFFFAOYSA-N
분자식: C8H6BrClO
평균 분자량: 233.49 g/mol
단동위원소 질량: 231.92905459

이름 및 식별자

우선 이름: Benzeneacetyl chloride, 4-bromo-
IUPAC: 2-(4-bromophenyl)acetyl chloride
영어명: 4-Bromophenylacetyl chloride
분자식: C8H6BrClO
분자량: 233.49

이름 및 동의어

37859-24-84-Bromophenylacetyl chlorideBenzeneacetyl chloride, 4-bromo-DTXSID70191297RefChem:562980DTXCID80113788634-836-82-(4-bromophenyl)acetyl chloride(4-Bromophenyl)acetyl chloride(4-bromo-phenyl)-acetyl chlorideMFCD001268424-bromophenylacetic acid chloride

이름 더 보기

SKL13052-(4-bromophenyl)ethanoyl chloride(4-Bromo-phenyl)-acetyl chloride ,95%

p-bromophenylacetyl chloride2-(4-bromophenyl)acetic acid chloride(4-Bromophenyl)acetylchloride4-Bromophenyl acetyl chlorideBenzeneacetyl chloride,4-bromo-4-bromophenyl acetylchloride4--bromophenylacetyl chloride4-bromo-phenylacetyl chloride

데이터베이스 식별자

CAS: 37859-24-8
PubChem CID: 181552
DTXSID: DTXSID70191297
EC Number: 634-836-8
Nikkaji: J1.181.609F

물성

구조 계산 물성

XLogP: 3.3
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: 141

물리화학적 성질

끓는 점: 180 · 180-185°C/10mm
밀도: 1.573 g/mL · 1.573 g/mL at 25 °C
인화점: 110 ℃ · >110℃
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

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

Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 4 (100%)

안전 데이터

wgk: 3
ridadr: 3265
risk_code: 34-22
hazard_code: C
safety_code: 26-36/37/39-45

화학 및 산업

응용 분야

용도4-Bromophenylacetyl chloride is a crucial compound that could be used as a pharmaceutical intermediate in pharmaceutical synthesis and scientific research.