(R)-(+)-3-(N-메틸아미노)-1-페닐-1-프로판올

(1R)-3-(methylamino)-1-phenylpropan-1-ol

HCID 7020931

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 115290-81-8
표준 SMILES: CNCC[C@@H](O)c1ccccc1
InChIKey: XXSDCGNHLFVSET-SNVBAGLBSA-N
분자식: C10H15NO
평균 분자량: 165.23 g/mol

이름 및 식별자

우선 이름: (1R)-3-(methylamino)-1-phenylpropan-1-ol
IUPAC: (1R)-3-(methylamino)-1-phenylpropan-1-ol
현지명: (R)-(+)-3-(N-메틸아미노)-1-페닐-1-프로판올
영어명: (R)-(+)-3-(N-Methylamino)-1-phenyl-1-propanol
분자식: C10H15NO
분자량: 165.23

이름 및 동의어

115290-81-8(1R)-3-(methylamino)-1-phenylpropan-1-olRefChem:393088974-947-1(R)-3-(methylamino)-1-phenylpropan-1-olDestolyl Atomoxetine(R)-3-(methylamino)-1-phenylpropanolFluoxetine Impurity 15MFCD00070087(r)-n-methyl-3-phenyl-3-hydroxypropylamine(3R)-N-Methyl-3-hydroxy-3-phenylpropylamine(1r)-(+)-3-(methylamino)-1-phenylpropan-1-ol

이름 더 보기

(R)-(+)-3-(N-메틸아미노)-1-페닐-1-프로판올Atomoxetine Impurity 3Tomoxetine impurity 13Atomoxetine Impurity 19AtoMoxetine Related CoMpound AAtomoxetine USP Related Compound AAtomoxetine hydrochloride impurity HAtomoxetine EP Impurity H (R-Isomer)

Benzenemethanol, alpha-[2-(methylamino)ethyl]-, (alphaR)-starbld0019046YX5G9C8ZLT(1R)-3-(methylamino)-1-phenyl-propan-1-olAtomoxetine EP Impurity HSCHEMBL1201340XXSDCGNHLFVSET-SNVBAGLBSA-NAKOS006272678

데이터베이스 식별자

CAS: 115290-81-8
PubChem CID: 7020931
UNII: YX5G9C8ZLT
EC Number: 974-947-1
Nikkaji: J663.248C

물성

구조 계산 물성

XLogP: 1
극성 표면적: 32.3 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 2
회전 가능 결합 수: 4
무거운 원자 수: 12
형식 전하: 0
복잡도: 110

물리화학적 성질

끓는 점: 286 ℃ · 286℃
밀도: 1.017 · 1.017
인화점: 115 ℃ · 115℃
산도 계수 (pKa): 14.24 · 14.24±0.20(Predicted)

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)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.