(4-브로모벤질)디메틸라민

4-Bromo-N,N-dimethylbenzylamine

HCID 235757

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 6274-57-3
표준 SMILES: CN(C)Cc1ccc(Br)cc1
InChIKey: RFEDQTSVZVRTGH-UHFFFAOYSA-N
분자식: C9H12BrN
평균 분자량: 214.1 g/mol
단동위원소 질량: 213.01531

이름 및 식별자

우선 이름: 4-Bromo-N,N-dimethylbenzylamine
IUPAC: 1-(4-bromophenyl)-N,N-dimethylmethanamine
현지명: (4-브로모벤질)디메틸라민
영어명: (4-Bromobenzyl)dimethylamine
분자식: C9H12BrN
분자량: 214.1

이름 및 동의어

4-Bromo-N,N-dimethylbenzylamineRefChem:520403815-955-66274-57-31-(4-bromophenyl)-n,n-dimethylmethanamine(4-BROMOBENZYL)DIMETHYLAMINEBenzenemethanamine, 4-bromo-N,N-dimethyl-[(4-bromophenyl)methyl]dimethylamineMFCD00032473(4-Bromo-benzyl)-dimethyl-amine4-Bromo-N,N-dimethyl-Benzenemethanamine1-(4-bromophenyl)-N,N-dimethyl-methanamine

이름 더 보기

(4-브로모벤질)디메틸라민(4-BROMOBENZYL)DIMETHYLBENZYLAMINE(4-Bromophenyl)-N,N-dimethylmethylamine[(4-bromophenyl)methyl]dimethylamine - [AC78543]

n,n-dimethyl-4-bromobenzylamineNSC374881-(4-Bromophenyl)-N,N-dimethylmethylamine4-bromodimethylbenzylamine4-(N,N-DIMETHYLAMINOMETHYL)BROMOBENZENESCHEMBL399795DTXSID80978379RFEDQTSVZVRTGH-UHFFFAOYSA-N

데이터베이스 식별자

CAS: 6274-57-3
PubChem CID: 235757
DTXSID: DTXSID80978379
EC Number: 815-955-6
Nikkaji: J1.319.089E

물성

구조 계산 물성

XLogP: 2.4
극성 표면적: 3.2 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 11
형식 전하: 0
복잡도: 106

물리화학적 성질

녹는점: 165 · 165-167 °C
끓는 점: 121 · 121-122 °C(Press: 20 Torr)
밀도: 1.32 · 1.320±0.06 g/cm3(Predicted)
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2-8°C
물리적 상태: 액체
산도 계수 (pKa): 8.56 · 8.56±0.28(Predicted)
색상: Clear, colourless

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

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