기본 정보
- CAS
1023-85-4- 표준 SMILES
CN1CN(c2ccccc2)C2(CCNCC2)C1=O.Cl- InChIKey
IFYWBEDKWLNJTM-UHFFFAOYSA-N- 분자식
- C14H20ClN3O
- 평균 분자량
- 281.78 g/mol
- 단동위원소 질량
- 281.12948994
이름 및 식별자
- 우선 이름
- 1,3,8-Triazaspiro(4.5)decan-4-one, 3-methyl-1-phenyl-, hydrochloride (1:1)
- IUPAC
- 3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;hydrochloride
이름 및 동의어
1023-85-41,3,8-Triazaspiro(4.5)decan-4-one, 3-methyl-1-phenyl-, hydrochlorideDTXSID10144883RefChem:1052650DTXCID70673741,3,8-Triazaspiro(4.5)decan-4-one, 3-methyl-1-phenyl-, hydrochloride (1:1)213-825-83-Methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one hydrochloride3-methyl-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one hydrochloride3-Methyl-1-phenyl-1,3,8-triazaspiro(4.5)decan-4-one hydrochloride3-methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one;hydrochloride3-Methyl-1-phenyl-1,3,8-triazaspiro(4,5)decan-4-one hydrochloride
이름 더 보기
NSC 118101EINECS 213-825-8SCHEMBL9485290NSC1181011,3,8-Triazaspiro[4,5]decan-4-one, 3-methyl-1-phenyl-, hydrochlorideNSC-1181013-Methyl-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-onehydrochloride3-Methyl-1-phenyl-1,8-triazaspiro[4.5]decan-4-one hydrochloride
데이터베이스 식별자
- CAS
1023-85-4- PubChem CID
- 197731
- DTXSID
DTXSID10144883- EC Number
물성
구조 계산 물성
- 극성 표면적
- 35.6 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 1
- 무거운 원자 수
- 19
- 형식 전하
- 0
- 복잡도
- 319
관련 반응
5건
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