Win 58768

HCID 148372CAS 152665-33-3

기본 정보

표준 SMILES
Cc1cc(-c2nnn(C)n2)cc(C)c1O
InChIKey
RYBFPEHWIREKRA-UHFFFAOYSA-N
분자식
C10H12N4O
평균 분자량
204.23 g/mol

개요

structure given in first source

이름 및 식별자

우선 이름
Win 58768
IUPAC
2,6-dimethyl-4-(2-methyltetrazol-5-yl)phenol
영어명
2,6-dimethyl-4-(2-methyl-1H-tetrazol-5-ylidene)cyclohexa-2,5-dien-1-on e
분자식
C10H12N4O
분자량
204.23

이름 및 동의어

152665-33-3Win 58768Win-58768RefChem:1948862,6-dimethyl-4-(2-methyltetrazol-5-yl)phenol2-methyl-5-(3,5-dimethyl-4-hydroxyphenyl)-2H-tetrazole5-(3,5-Dimethyl-4-hydroxyphenyl)-2-methyltetrazoleSCHEMBL8553788SCHEMBL8556589DTXSID10934564RYBFPEHWIREKRA-UHFFFAOYSA-N2,6-DIMETHYL-4-(2-METHYL-1H-TETRAZOL-5-YLIDENE)CYCLOHEXA-2,5-DIEN-1-ON E
이름 더 보기
4-(2-methyl-tetrazol-5-yl)-2,6-dimethylphenol2-methyl-5-(3,5-dimethyl-4-hydroxyphenyl)tetrazolePhenol, 2,6-dimethyl-4-(2-methyl-2H-tetrazol-5-yl)-Tetrazole, 5-(3,5-dimethyl-4-hydroxyphenyl)-2-methyl-2,6-Dimethyl-4-(2-methyl-1,2-dihydro-5H-tetrazol-5-ylidene)cyclohexa-2,5-dien-1-one

데이터베이스 식별자

CAS
152665-33-3
PubChem CID
148372
DTXSID
DTXSID10934564
Nikkaji
J845.179F

물성

구조 계산 물성

XLogP
2.2
극성 표면적
63.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
15

물리화학적 성질

끓는 점
405.9 · 405.9±55.0 °C(Predicted)
밀도
1.3 · 1.30±0.1 g/cm3(Predicted)
산도 계수 (pKa)
8.6 · 8.60±0.25(Predicted)

화학 및 산업

공급사2 곳

HONEST JOY HOLDINGS LIMITED[email protected]
CHEMICAL LAND21[email protected]

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