N-메틸-1-페네틸아민

N-Methyl-1-phenylethylamine

HCID 577403

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 32512-24-6
표준 SMILES: CNC(C)c1ccccc1
InChIKey: RCSSHZGQHHEHPZ-UHFFFAOYSA-N
분자식: C9H13N
평균 분자량: 135.21 g/mol
단동위원소 질량: 135.10479942

개요

N-methyl-1-phenylethylamine has been reported in Vachellia rigidula with data available.

이름 및 식별자

우선 이름: N-Methyl-1-phenylethylamine
IUPAC: N-methyl-1-phenylethanamine
현지명: N-메틸-1-페네틸아민
영어명: N-methyl-1-phenethylamine
분자식: C9H13N
분자량: 135.21

이름 및 동의어

N-Methyl-1-phenylethanamine32512-24-6methyl(1-phenylethyl)amineN-methyl-1-phenylethylamineMapea8V1UF8Q1P1N,alpha-Dimethylbenzenemethanaminen,alpha-dimethylbenzylaminealpha,N-DimethylbenzylamineBenzenemethanamine, N,.alpha.-dimethyl-Benzylamine, N,alpha-dimethyl-DTXSID901342325

이름 더 보기

N-메틸-1-페네틸아민N-methyl-1-phenethylamineBenzenemethanamine, N,α-dimethyl-N-Methyl-1-phenylethylamine hydrochloride

.ALPHA.,N-DIMETHYLBENZYLAMINEN,.ALPHA.-DIMETHYLBENZYLAMINEBenzenemethanamine, N,alpha-dimethyl-BENZYLAMINE, N,.ALPHA.-DIMETHYL-N,.ALPHA.-DIMETHYLBENZENEMETHANAMINERefChem:830330DTXCID70881186823-889-4

데이터베이스 식별자

CAS: 32512-24-6
PubChem CID: 577403
DTXSID: DTXSID901342325
UNII: 8V1UF8Q1P1
EC Number: 823-889-4
Nikkaji: J544.963D

물성

구조 계산 물성

XLogP: 1.7
극성 표면적: 12 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 1
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 84.7

실험 및 물리화학적 성질

Collision Cross Section138.1 Å² [M+Na]+

물리화학적 성질

끓는 점: 178.7 · 178.7±9.0 °C(Predicted)
밀도: 0.911 · 0.911±0.06 g/cm3(Predicted)
저장 조건: 2 · 2-8°C(protect from light)
산도 계수 (pKa): 9.77 · 9.77±0.10(Predicted)

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]

P233, P260, P261, P264, P270, P271, P272, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P333+P317, P342+P316, P362+P364, P363, P403, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.