CAS 8000-52-0 Simazine-methoprotryn mixt. (HCID 56842098)

기본 정보

CAS: 8000-52-0
표준 SMILES: CCNc1nc(Cl)nc(NCC)n1.COCCCNc1nc(NC(C)C)nc(SC)n1
InChIKey: RHGLURZJQLTNBD-UHFFFAOYSA-N
분자식: C18H33ClN10OS
평균 분자량: 473 g/mol
단동위원소 질량: 472.2248046

이름 및 식별자

우선 이름: Simazine-methoprotryn mixt.
IUPAC: 6-chloro-2-N,4-N-diethyl-1,3,5-triazine-2,4-diamine;4-N-(3-methoxypropyl)-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

이름 및 동의어

Simazine-methoprotryn mixt.8000-52-0AvetitGesaran 207Gesaran 211Gesaran 2079Methoprotryn - simazine mixt.Simazine - methoprotryn mixt.DTXSID802300001,3,5-Triazine-2,4-diamine, 6-chloro-N,N'-diethyl-, mixt. with N-(3-methoxypropyl)-N'-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine6-Chloro-N,N'-diethyl-1,3,5-triazine-2,4-diamine mixt. with N-(3-methoxypropyl)-N'-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamineN~2~-(3-Methoxypropyl)-6-(methylsulfanyl)-N~4~-(propan-2-yl)-1,3,5-triazine-2,4-diamine--6-chloro-N~2~,N~4~-diethyl-1,3,5-triazine-2,4-diamine (1/1)

데이터베이스 식별자

CAS: 8000-52-0
PubChem CID: 56842098
DTXSID: DTXSID80230000

물성

구조 계산 물성

극성 표면적: 160 Å²
수소 결합 공여자 수: 4
수소 결합 수용자 수: 12
회전 가능 결합 수: 12
무거운 원자 수: 31
형식 전하: 0
복잡도: 350

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