3-(4-메톡시페닐)프로필브로마이드

1-(3-Bromopropyl)-4-methoxybenzene

HCID 12776996

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 57293-19-3
표준 SMILES: COc1ccc(CCCBr)cc1
InChIKey: CPHLODVMQBMDNC-UHFFFAOYSA-N
분자식: C10H13BrO
평균 분자량: 229.11 g/mol
단동위원소 질량: 228.01497714

이름 및 식별자

우선 이름: 1-(3-Bromopropyl)-4-methoxybenzene
IUPAC: 1-(3-bromopropyl)-4-methoxybenzene
현지명: 3-(4-메톡시페닐)프로필브로마이드
영어명: 3-(4-Methoxyphenyl)propyl bromide
분자식: C10H13BrO
분자량: 229.11

이름 및 동의어

1-(3-Bromopropyl)-4-methoxybenzene57293-19-3DTXSID20509580RefChem:224247DTXCID00460387626-194-2MFCD001550661-bromo-3-(4-methoxyphenyl)propane1-(3-bromo-propyl)-4-methoxy-benzene3-(4-methoxyphenyl)-1-propyl bromideCS-0150357EN300-675189

이름 더 보기

3-(4-메톡시페닐)프로필브로마이드4-(3-Bromopropyl)anisole3-(4-Methoxyphenyl)propyl bromide4-(3-bromopropyl)benzenemethylether1-(3-BroMopropyl)-4-Methoxybenzene 97%1-(3-Bromopropyl)-4-methoxybenzene - [B92984]3-(4-Methoxyphenyl)propyl bromide, 4-(3-Bromopropyl)anisole

Benzene, 1-(3-bromopropyl)-4-methoxy-FT-0718772SCHEMBL800833-(4-methoxyphenyl)bromopropaneSCHEMBL277110233-(p-methoxyphenyl)-1-propylbrom3-(p-methoxyphenyl)-1-propylbromide3-(4-methoxyphenyl)-1-propylbromide

데이터베이스 식별자

CAS: 57293-19-3
PubChem CID: 12776996
DTXSID: DTXSID20509580
EC Number: 626-194-2
Nikkaji: J1.274.957K

물성

구조 계산 물성

XLogP: 3.6
극성 표면적: 9.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 12
형식 전하: 0
복잡도: 108

물리화학적 성질

끓는 점: 104 · 104-106 °C/0.2 mmHg
밀도: 1.311 g/mL · 1.311 g/mL at 25 °C
굴절률: 20 · n20/D 1.548
인화점: 110 °C · 110 °C
저장 조건: Sealed in dry,Room Temperature
물리적 상태: liquid
InChI: 1S/C10H13BrO/c1-12-10-6-4-9(5-7-10)3-2-8-11/h4-7H,2-3,8H2,1H3
InChIKey: CPHLODVMQBMDNC-UHFFFAOYSA-N
SMILES: COc1ccc(CCCBr)cc1

화학적 성질

3-(4-methoxyphenyl)propyl bromide is a colorless liquid, it forms explosive mixtures with air on intense heating.

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.