6-클로로-N-메틸-피리미딘-4,5-디아민

6-chloro-N4-methylpyrimidine-4,5-diamine

HCID 308477

노트 반응

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 52602-68-3
표준 SMILES: CNc1ncnc(Cl)c1N
InChIKey: RIYBSFHJIOZYLD-UHFFFAOYSA-N
분자식: C5H7ClN4
평균 분자량: 158.59 g/mol
단동위원소 질량: 158.0359239

이름 및 식별자

우선 이름: 6-chloro-N4-methylpyrimidine-4,5-diamine
IUPAC: 6-chloro-4-N-methylpyrimidine-4,5-diamine
현지명: 6-클로로-N-메틸-피리미딘-4,5-디아민
영어명: 6-chloro-N-methyl-pyrimidine-4,5-diamine
분자식: C5H7ClN4
분자량: 158.59

이름 및 동의어

6-Chloro-N4-Methylpyrimidine-4,5-DiamineRefChem:541911843-957-752602-68-36-Chloro-N4-methyl-4,5-pyrimidinediamineMFCD073641746-chloro-4-N-methylpyrimidine-4,5-diamine4-(Methylamino)-5-amino-6-chloropyrimidine6-CHLORO-N-METHYL-PYRIMIDINE-4,5-DIAMINE6-Chloro-N4-methyl-pyrimidine-4,5-diamine4,5-Pyrimidinediamine, 6-chloro-N4-methyl-NSC210278

이름 더 보기

6-클로로-N-메틸-피리미딘-4,5-디아민6-Chloro-4-methyl-4,5-diaminopyrimidine5-Amino-6-chloro-4-(methylamino)pyrimidine4-Chloro-5-amino-6-(methylamino)pyrimidine6-chloro-N4-methylpyrimidine-4,5-diamine - [C86892]6-chloro-4-Methyl-4,5-dihydropyriMidine-4,5-diaMine

6-Chloro-N4-methyl-pyriSCHEMBL766829DTXSID90308860RIYBSFHJIOZYLD-UHFFFAOYSA-NALBB-031117SBB040183AKOS000268558NC44314

데이터베이스 식별자

CAS: 52602-68-3
PubChem CID: 308477
DTXSID: DTXSID90308860
EC Number: 843-957-7

물성

구조 계산 물성

XLogP: 0.8
극성 표면적: 63.8 Å²
수소 결합 공여자 수: 2
수소 결합 수용자 수: 4
회전 가능 결합 수: 1
무거운 원자 수: 10
형식 전하: 0
복잡도: 110

물리화학적 성질

녹는점: 62 ℃ · 62℃
밀도: 1.447 · 1.447
저장 조건: 2 · under inert gas (nitrogen or Argon) at 2–8 °C

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.