2-METHYL-3-(TRIFLUOROMETHYL)BENZYL브로마이드

1-(Bromomethyl)-2-methyl-3-(trifluoromethyl)benzene

HCID 2775617

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 261952-16-3
표준 SMILES: Cc1c(CBr)cccc1C(F)(F)F
InChIKey: YSABBOPLIUMXKY-UHFFFAOYSA-N
분자식: C9H8BrF3
평균 분자량: 253.06 g/mol
단동위원소 질량: 251.97614702

이름 및 식별자

우선 이름: 1-(Bromomethyl)-2-methyl-3-(trifluoromethyl)benzene
IUPAC: 1-(bromomethyl)-2-methyl-3-(trifluoromethyl)benzene
현지명: 2-METHYL-3-(TRIFLUOROMETHYL)BENZYL브로마이드
영어명: 2-Methyl-3-(trifluoromethyl)benzyl bromide
분자식: C9H8BrF3
분자량: 253.06

이름 및 동의어

261952-16-31-(bromomethyl)-2-methyl-3-(trifluoromethyl)benzene2-Methyl-3-(trifluoromethyl)benzyl bromideDTXSID90379616RefChem:427239DTXCID50330642679-143-1MFCD01631608Benzene, 1-(bromomethyl)-2-methyl-3-(trifluoromethyl)-2-METHYL-3-TRIFLUOROMETHYLBENZYL BROMIDESCHEMBL7241892-Methyl-3-(trifluoromethyl)benzylbromide

이름 더 보기

2-METHYL-3-(TRIFLUOROMETHYL)BENZYL브로마이드2-Methyl-3-(trifluoromethyl)benzylbromide98%2-Methyl-3-(trifluoromethyl)benzyl bromide 98%

BCP24586SCHEMBL30513592CL8710SBB101204AKOS015919729AS-46082SY106767DB-006187

데이터베이스 식별자

CAS: 261952-16-3
PubChem CID: 2775617
DTXSID: DTXSID90379616
EC Number: 679-143-1

물성

구조 계산 물성

XLogP: 3.7
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: 167

물리화학적 성질

끓는 점: 72 °C/1mm · 72°C/1mm
밀도: 1.499 · 1.499
인화점: 72 °C/1mm · 72°C/1mm
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, 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.