2-(chloromethyl)-N,N-dimethylaniline hydrochloride

HCID 13537426

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 104340-39-8
표준 SMILES: CN(C)c1ccccc1CCl.Cl
InChIKey: NDGRHDGMNRMJOP-UHFFFAOYSA-N
분자식: C9H13Cl2N
평균 분자량: 206.11 g/mol
단동위원소 질량: 205.04250478

이름 및 식별자

우선 이름: 2-(chloromethyl)-N,N-dimethylaniline hydrochloride
IUPAC: 2-(chloromethyl)-N,N-dimethylaniline;hydrochloride

이름 및 동의어

2-(chloromethyl)-N,N-dimethylaniline hydrochlorideRefChem:460352861-255-9104340-39-82-(chloromethyl)-N,N-dimethylaniline;hydrochlorideSCHEMBL8657787SCHEMBL9266349DTXSID40543209NDGRHDGMNRMJOP-UHFFFAOYSA-NEEA34039AT332412-dimethylaminobenzylchloride hydrochloride

이름 더 보기

2-dimethylaminobenzyl chloride hydrochlorideEN300-84314(2-chloromethylphenyl)dimethylammonium chloride(2-chloromethylphenyl)-dimethylammonium chloride2-(chloromethyl)-N,N-dimethylanilinehydrochloride2-(Chloromethyl)-N,N-dimethylaniline--hydrogen chloride (1/1)Benzenamine, 2-(chloromethyl)-N,N-dimethyl-, hydrochloride (1:1)

데이터베이스 식별자

CAS: 104340-39-8
PubChem CID: 13537426
DTXSID: DTXSID40543209
EC Number: 861-255-9

물성

구조 계산 물성

극성 표면적: 3.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 12
형식 전하: 0
복잡도: 114

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

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

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, 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.