2-Bromo-1-(4-(trifluoromethyl)phenyl)propan-1-one

HCID 10423819CAS 95728-57-7

기본 정보

표준 SMILES: CC(Br)C(=O)c1ccc(C(F)(F)F)cc1
InChIKey: NFXCMWCJLDRJIM-UHFFFAOYSA-N
분자식: C10H8BrF3O
평균 분자량: 281.07 g/mol
단동위원소 질량: 279.97106164

이름 및 식별자

우선 이름: 2-Bromo-1-(4-(trifluoromethyl)phenyl)propan-1-one
IUPAC: 2-bromo-1-[4-(trifluoromethyl)phenyl]propan-1-one
영어명: 2-Bromo-1-[4-(trifluoromethyl)phenyl]propan-1-one, 4-(2-Bromopropanoyl)benzotrifluoride
분자식: C10H8BrF3O
분자량: 281.07

이름 및 동의어

95728-57-72-BROMO-1-(4-(TRIFLUOROMETHYL)PHENYL)PROPAN-1-ONE2-bromo-1-[4-(trifluoromethyl)phenyl]propan-1-oneDTXSID40439714RefChem:256826DTXCID20390536871-368-52-Bromo-4'-(trifluoromethyl)propiophenoneMFCD170102341-Propanone, 2-bromo-1-[4-(trifluoromethyl)phenyl]-SCHEMBL7868342-Bromo-1-[4-(trifluoromethyl)phenyl]-1-propanone

이름 더 보기

1-propanone, 2-broMo-1-[4- (trifloroMethyl)phenyl

VDA72857AKOS0302299022-Bromo-1-[4-(trifluoromethyl)phenyl]propan-1-one, 4-(2-Bromopropanoyl)benzotrifluorideAS-35452SY358379DB-364660CS-0199794EN300-3361578

데이터베이스 식별자

CAS: 95728-57-7
PubChem CID: 10423819
DTXSID: DTXSID40439714
EC Number: 871-368-5
Nikkaji: J1.882.242C

물성

구조 계산 물성

XLogP: 3.7
극성 표면적: 17.1 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 4
회전 가능 결합 수: 2
무거운 원자 수: 15
형식 전하: 0
복잡도: 231

물리화학적 성질

물리적 상태: 고체

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

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

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.