Cinnamyl bromide

HCID 5357478

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 26146-77-0
표준 SMILES: BrC/C=C/c1ccccc1
InChIKey: RUROFEVDCUGKHD-QPJJXVBHSA-N
분자식: C9H9Br
평균 분자량: 197.07 g/mol
단동위원소 질량: 195.98876

이름 및 식별자

우선 이름: Cinnamyl bromide
IUPAC: [(E)-3-bromoprop-1-enyl]benzene
영어명: (E)-(3-broMoprop-1-en-1-yl)benzene
분자식: C9H9Br
분자량: 197.07

이름 및 동의어

Cinnamyl bromide4392-24-9EINECS 224-511-5NSC 78446DTXSID60871071RefChem:577221DTXCID60818744224-511-5(3-Bromo-1-propen-1-yl)benzene(3-bromoprop-1-en-1-yl)benzene(E)-(3-Bromoprop-1-en-1-yl)benzene26146-77-0

이름 더 보기

(E)?-?(3-?BROMO-?PROPENYL)?-?BENZENEBenzene, [(1E)-3-bromo-1-propen-1-yl]-

3-Bromo-1-phenyl-1-propene3-phenyl-2-propenyl bromide[(E)-3-bromoprop-1-enyl]benzeneMFCD00000245[(1E)-3-bromoprop-1-en-1-yl]benzene3-Bromo-1-phenyl propene-1(E)-(3-Bromo-1-propenyl)benzene(E)-cinnamyl bromide

데이터베이스 식별자

CAS: 26146-77-0、4392-24-9
PubChem CID: 5357478
EC Number: 224-511-5、871-240-9
Nikkaji: J205.770K、J478.801J

물성

구조 계산 물성

XLogP: 3.4
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 101

물리화학적 성질

녹는점: 26 · 26-28 °C(Solv: hexane (110-54-3))
끓는 점: 100 · 100-105 °C(Press: 20 Torr)
밀도: 1.372 · 1.372±0.06 g/cm3(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 5건

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 46 reports by companies from 4 notifications to the ECHA C&L Inventory.；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.