CAS 657-64-7 2-Bromo-1-(bromomethyl)-4-(trifluoromethyl)benzene (HCID 14949936)

기본 정보

CAS: 657-64-7
표준 SMILES: FC(F)(F)c1ccc(CBr)c(Br)c1
InChIKey: QXNLLMCGCALGBW-UHFFFAOYSA-N
분자식: C8H5Br2F3
평균 분자량: 317.93 g/mol
단동위원소 질량: 315.87101

이름 및 식별자

우선 이름: 2-Bromo-1-(bromomethyl)-4-(trifluoromethyl)benzene
IUPAC: 2-bromo-1-(bromomethyl)-4-(trifluoromethyl)benzene
현지명: 2-브로모-4-(트리플루오로메틸)벤질브로마이드
영어명: 2-Bromo-4-(trifluoromethyl)benzyl bromide
분자식: C8H5Br2F3
분자량: 317.93

이름 및 동의어

657-64-72-BROMO-1-(BROMOMETHYL)-4-(TRIFLUOROMETHYL)BENZENE2-Bromo-4-(trifluoromethyl)benzyl bromideDTXSID50565937RefChem:466010DTXCID60516713816-205-0MFCD11847628SCHEMBL1992103Benzene, 2-bromo-1-(bromomethyl)-4-(trifluoromethyl)-SCHEMBL30030832CL9075

이름 더 보기

2-브로모-4-(트리플루오로메틸)벤질브로마이드2-bromo-1-(bromethyl)-4-(trifluoromethyl)benzene

AKOS0273750472-bromo-4-trifluoromethylbenzyl bromideAS-46199SY258627DB-2513522-bromo-1-bromomethyl-4-trifluoromethyl-benzeneF334217

데이터베이스 식별자

CAS: 657-64-7
PubChem CID: 14949936
DTXSID: DTXSID50565937
EC Number: 816-205-0

물성

구조 계산 물성

XLogP: 4.1
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 13
형식 전하: 0
복잡도: 169

물리화학적 성질

끓는 점: 246.5 · 246.5±35.0 °C(Predicted)
밀도: 1.885 · 1.885±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 액체
색상: Clear, colourless

안전 및 규제

GHS 분류

GHS Classification · 5건

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P362+P364, P363, 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.