2,2-Dichloroacetophenone

HCID 72870CAS 2648-61-5

기본 정보

표준 SMILES: O=C(c1ccccc1)C(Cl)Cl
InChIKey: CERJZAHSUZVMCH-UHFFFAOYSA-N
분자식: C8H6Cl2O
평균 분자량: 189.04 g/mol
단동위원소 질량: 187.9795702

이름 및 식별자

우선 이름: 2,2-Dichloroacetophenone
IUPAC: 2,2-dichloro-1-phenylethanone
영어명: 2,2-Dichloroacetophenone
분자식: C8H6Cl2O
분자량: 189.04

이름 및 동의어

2,2-Dichloroacetophenone2648-61-52,2-Dichloro-1-phenylethanoneEthanone, 2,2-dichloro-1-phenyl-Acetophenone, 2,2-dichloro-alpha,alpha-DichloroacetophenoneDTXSID10519393VJ32JJ8LHNSC-53617DTXCID8030502RefChem:80986677-377-9

이름 더 보기

Dichloroacetylbenzene(Dichloroacetyl)benzene2,2-dichloro-acetophenonA A-DICHLOROACETOPHENONEà,à-dichloroacetophenoneBETA-DICHLOROACETOPHENONE

Phenacylidene chloride1,1-Dichloroacetophenone2,2-dichloro-1-phenylethan-1-one.alpha.,.alpha.-DichloroacetophenoneMFCD000008442,2-dichloro-1-phenyl-ethanone.omega.,.omega.-DichloroacetophenoneCHEMBL3560171

데이터베이스 식별자

CAS: 2648-61-5
PubChem CID: 72870
DTXSID: DTXSID1051939
ChEMBL: CHEMBL3560171
UNII: 3VJ32JJ8LH
EC Number: 677-377-9
Nikkaji: J31.096D

물성

구조 계산 물성

XLogP: 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: 139

물리화학적 성질

녹는점: 20 · 20-21 °C (lit.)
끓는 점: 132 · 132-134 °C/13 mmHg (lit.)
밀도: 1.34 g/mL · 1.34 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.5686(lit.)
인화점: 230 °F · >230 °F
용해도: 클로로포름(약간 용해됨), DMSO(약간 용해됨), 메탄올(약간 용해됨)
물리적 상태: 투명한 액체
색상: Colorless to Red to Green
BRN: 1864186 · 1864186
InChI: 1S/C8H6Cl2O/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,8H
InChIKey: CERJZAHSUZVMCH-UHFFFAOYSA-N
SMILES: ClC(Cl)C(C1=CC=CC=C1)=O
EPA: 2 · Ethanone, 2,2-dichloro-1-phenyl- (2648-61-5)

화학적 성질

CLEAR COLOURLESS TO SLIGHTLY PINK LIQUID

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (80%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (80%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)

안전 데이터

wgk: 3
tsca: TSCA listed
rtecs: AM7175000
ridadr: UN 2810 6.1/PG 2
독성: mouse,LCLo,inhalation,940mg/m3/10M (940mg/m3),National Defense Research Committee, Office of Scientific Research and Development, Progress Report.Vol. NDCrc-132, Pg. AUG1942,
HS 번호: 29147000
risk_code: 36/37/38
hazard_code: Xn,Xi
safety_code: 26-27-28-36/37/39-7/9
포장분류: II
스토리지 클래스: 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials

화학 및 산업

용도 및 제조

General Manufacturing InformationEthanone, 2,2-dichloro-1-phenyl-: INACTIVE

상·하류 제품 정보

상류 원료

공급사50 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

Syntechem Co.,Ltd[email protected]

연결된 노트

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