(3-클로로-3-페닐-프로필)-디메틸아민염산염

3-Chloro-N,N-dimethyl-3-phenylpropan-1-amine--hydrogen chloride (1/1)

HCID 12707240

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 1011-59-2
표준 SMILES: CN(C)CCC(Cl)c1ccccc1.Cl
InChIKey: KJBOLGFVUPJVKR-UHFFFAOYSA-N
분자식: C11H17Cl2N
평균 분자량: 234.16 g/mol
단동위원소 질량: 233.0738049

이름 및 식별자

우선 이름: 3-Chloro-N,N-dimethyl-3-phenylpropan-1-amine--hydrogen chloride (1/1)
IUPAC: 3-chloro-N,N-dimethyl-3-phenylpropan-1-amine;hydrochloride
현지명: (3-클로로-3-페닐-프로필)-디메틸아민염산염
영어명: (3-Chloro-3-phenyl-propyl)-dimethyl-amine hydrochloride
분자식: C11H16ClN
분자량: 197.7

이름 및 동의어

79130-51-1DTXSID605075403-Chloro-N,N-dimethyl-3-phenylpropan-1-amine--hydrogen chloride (1/1)RefChem:278520DTXCID804583481011-59-23-Chloro-N,N-dimethyl-3-phenylpropan-1-amine hydrochloride(3-CHLORO-3-PHENYL-PROPYL)-DIMETHYL-AMINE HYDROCHLORIDEn,n-dimethyl-3-phenyl-3-chloropropylamine hydrochlorideMFCD04114488Atomoxetine Impurity 83-chloro-N,N-dimethyl-3-phenylpropan-1-amine;hydrochloride

이름 더 보기

(3-클로로-3-페닐-프로필)-디메틸아민염산염NPC Chloro compoundTomoxetine impurity 21Atomoxetine Impurity 24Atomoxetine Impurity 9 HClAtomoxetine Impurity 2 HCl(3-Chloro-3-phenyl-propyl)-dimethyl-amineBenzenepropanamine, γ-chloro-N,N-dimethyl-3-chloro-N,N-dimethyl-3-phenylpropan-1-amineN-(3-chloro-3-phenylpropyl)-N,N-dimethylamine(3-Choro-3-phenyl-propyl)-dimethyl-amine hydrochloride

(3-chloro-3-phenylpropyl)dimethylamine hydrochloride3-chloro-N,N-dimethyl-3-phenyl-1-propanamine hydrochlorideBenzenepropanamine, gamma-chloro-N,N-dimethyl-, hydrochloride (1:1)KJBOLGFVUPJVKR-UHFFFAOYSA-NSCHEMBL4374402BAA01159SB30102DA-48389

데이터베이스 식별자

CAS: 1011-59-2、79130-51-1
PubChem CID: 12707240
DTXSID: DTXSID60507540
EC Number: 808-844-9

물성

구조 계산 물성

극성 표면적: 3.2 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 4
무거운 원자 수: 14
형식 전하: 0
복잡도: 130

물리화학적 성질

녹는점: 176 °C · 176 °C
끓는 점: 261.7 · 261.7±33.0 °C(Predicted)
밀도: 1.034 · 1.034±0.06 g/cm3(Predicted)
산도 계수 (pKa): 9.16 · 9.16±0.28(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264+P265, P280, P305+P351+P338, and P337+P317 (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.

유해성 정보

Hazard Classes and CategoriesEye Irrit. 2A (100%)

화학 및 산업

공급사12 곳

天津始加生物医药科技有限公司15022261580 · [email protected]

湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]

普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]

梯尔希（南京）药物研发有限公司18012923235 · [email protected]

화합물 노트

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