4-(아미노메틸)-1-메틸-피페리딘-4-올

4-(Aminomethyl)-1-methylpiperidin-4-ol

HCID 6484262CAS 26228-68-2

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CN1CCC(O)(CN)CC1
InChIKey: JUHFGHWNBYGKCW-UHFFFAOYSA-N
분자식: C7H16N2O
평균 분자량: 144.21 g/mol
단동위원소 질량: 144.12626313

이름 및 식별자

우선 이름: 4-(Aminomethyl)-1-methylpiperidin-4-ol
IUPAC: 4-(aminomethyl)-1-methylpiperidin-4-ol
현지명: 4-(아미노메틸)-1-메틸-피페리딘-4-올
영어명: 4-(Aminomethyl)-1-methyl-piperidin-4-ol
분자식: C7H16N2O
분자량: 144.21

이름 및 동의어

4-(aminomethyl)-1-methylpiperidin-4-ol26228-68-2DTXSID20424441RefChem:514977DTXCID50375275831-934-44-Aminomethyl-1-methyl-piperidin-4-ol4-aminomethyl-4-hydroxy-1-methylpiperidineMFCD081441054-PIPERIDINOL, 4-(AMINOMETHYL)-1-METHYL-4-piperidinol, 4-(aminomethyl)-1-methyl-, dihydrochloride4-(aminomethyl)-1-methyl-piperidin-4-ol

이름 더 보기

4-(아미노메틸)-1-메틸-피페리딘-4-올4-aMinoMethyl-4-hydroxy-1-Methylpiperidine(HCl)4-(aminomethyl)-1-methylpiperidin-4-ol(SALTDATA: 2HCl)4-(aminomethyl)-1-methylpiperidin-4-ol dihydrochloride

4-Aminomethyl-1-methylpiperidin-4-olSCHEMBL103283JUHFGHWNBYGKCW-UHFFFAOYSA-NALBB-012775AKOS0005060864(aminomethyl)-1-methyl-4-piperidinolAC-3554PB14543

데이터베이스 식별자

CAS: 26228-68-2
PubChem CID: 6484262
DTXSID: DTXSID20424441
EC Number: 831-934-4

물성

구조 계산 물성

XLogP: -1
극성 표면적: 49.5 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 3
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 108

물리화학적 성질

끓는 점: 255.7 · 255.7±15.0 °C(Predicted)
밀도: 1.047 · 1.047±0.06 g/cm3(Predicted)
산도 계수 (pKa): 12.55 · 12.55±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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.