3-(2-Methyl-6-methylthiophenyl)-4,5-dihydroisoxazole

HCID 10878342

기본 정보

표준 SMILES
CSc1cccc(C)c1C1=NOCC1
InChIKey
ZTJWBDREQSNUKG-UHFFFAOYSA-N
분자식
C11H13NOS
평균 분자량
207.29 g/mol

이름 및 식별자

우선 이름
3-(2-Methyl-6-methylthiophenyl)-4,5-dihydroisoxazole
IUPAC
3-(2-methyl-6-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole

이름 및 동의어

250592-91-73-(2-methyl-6-methylthiophenyl)-4,5-dihydroisoxazole3-(2-Methyl-6-(methylthio)phenyl)-4,5-dihydroisoxazoleSCHEMBL702182SCHEMBL30480757ZTJWBDREQSNUKG-UHFFFAOYSA-N3-((2-Methyl)-6-methylthiophenyl)-4,5-dihydroisoxazole3-(2-methyl-6-methylthiophenyl) -4,5-dihydroisoxazole3-(2-methyl-6-methylthiophenyl)-4,5-dihydro-isoxazole3-(2-methyl-6-methylsulfanylphenyl)-4,5-dihydro-1,2-oxazole

데이터베이스 식별자

PubChem CID
10878342

물성

구조 계산 물성

XLogP
2.7
극성 표면적
46.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
3
회전 가능 결합 수
2
무거운 원자 수
14

관련 반응

32건

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