4-피페리딘-1-일메틸-페닐아민

4-(Piperidin-1-ylmethyl)aniline

HCID 846150CAS 29608-05-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: Nc1ccc(CN2CCCCC2)cc1
InChIKey: DRYFDUUAYSVNSN-UHFFFAOYSA-N
분자식: C12H18N2
평균 분자량: 190.28 g/mol
단동위원소 질량: 190.14699858

이름 및 식별자

우선 이름: 4-(Piperidin-1-ylmethyl)aniline
IUPAC: 4-(piperidin-1-ylmethyl)aniline
현지명: 4-피페리딘-1-일메틸-페닐아민
영어명: 4-Piperidin-1-ylmethyl-phenylamine
분자식: C12H18N2
분자량: 190.28

이름 및 동의어

4-(piperidin-1-ylmethyl)aniline29608-05-7DTXSID80357165RefChem:289338DTXCID90308224810-866-94-Piperidin-1-ylmethyl-phenylamine4-(PIPERIDYLMETHYL)ANILINE4-(1-piperidinylmethyl)anilineBENZENAMINE, 4-(1-PIPERIDINYLMETHYL)-4-(Piperidylmethyl)phenylamine4-piperidin-1-ylmethyl-aniline

이름 더 보기

4-피페리딘-1-일메틸-페닐아민AKOS B014375AKOS MSC-0180ASISCHEM W54645TIMTEC-BB SBB007056ART-CHEM-BB B014375ART-CHEM-BB B0160204-(1-piperidylmethyl)aniline

4-aminobenzylpiperidineMFCD034225164-[(piperidin-1-yl)methyl]aniline4-(piperidin-1-ylmethyl)benzenamine4-(Piperidinomethyl)aniline1-(4-Aminobenzyl)piperidineBAS 054384884-piperidin-1-ylmethylphenylamine

데이터베이스 식별자

CAS: 29608-05-7
PubChem CID: 846150
DTXSID: DTXSID80357165
EC Number: 810-866-9
Nikkaji: J2.502.212B

물성

구조 계산 물성

XLogP: 1.9
극성 표면적: 29.3 Å²
수소 결합 공여자 수: 1
수소 결합 수용자 수: 2
회전 가능 결합 수: 2
무거운 원자 수: 14
형식 전하: 0
복잡도: 156

물리화학적 성질

녹는점: 90 · 90-93
끓는 점: 308.7 · 308.7±17.0 °C(Predicted)
밀도: 1.068 · 1.068±0.06 g/cm3(Predicted)
저장 조건: Keep in dark place,Inert atmosphere,Room temperature
물리적 상태: 결정성 분말
산도 계수 (pKa): 9 · 9+-.0.10(Predicted)
색상: 갈색

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H302+H312+H332 (25%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.