Isoxazole, 3-[3-bromo-2-methyl-6-(methylthio)phenyl]-4,5-dihydro-

HCID 9860657CAS 250592-92-8

기본 정보

표준 SMILES
CSc1ccc(Br)c(C)c1C1=NOCC1
InChIKey
BJKHEGMQFCIUHE-UHFFFAOYSA-N
분자식
C11H12BrNOS
평균 분자량
286.19 g/mol
단동위원소 질량
284.9822971

이름 및 식별자

우선 이름
Isoxazole, 3-[3-bromo-2-methyl-6-(methylthio)phenyl]-4,5-dihydro-
IUPAC
3-(3-bromo-2-methyl-6-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole

이름 및 동의어

250592-92-83-(3-Bromo-2-methyl-6-(methylthio)phenyl)-4,5-dihydroisoxazole3-(3-Bromo-2-methyl-6-methylthiophenyl)-4,5-dihydroisoxazoleIsoxazole, 3-[3-bromo-2-methyl-6-(methylthio)phenyl]-4,5-dihydro-SCHEMBL701014DTXSID50432014BJKHEGMQFCIUHE-UHFFFAOYSA-N3-(3-bromo-2-methyl-6-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole3-[3-BROMO-2-METHYL-6-(METHYLSULFANYL)PHENYL]-4,5-DIHYDRO-1,2-OXAZOLE

데이터베이스 식별자

CAS
250592-92-8
PubChem CID
9860657
DTXSID
DTXSID50432014

물성

구조 계산 물성

XLogP
3.4
극성 표면적
46.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
15

관련 반응

16건

연결된 노트

불러오는 중…