Benzaldehyde, 5-(4,5-dihydro-2-oxazolyl)-2-((5-(3-methyl-5-isoxazolyl)pentyl)oxy)-

HCID 5271233

기본 정보

CAS
105639-13-2
표준 SMILES
Cc1cc(CCCCCOc2ccc(C3=NCCO3)cc2C=O)on1
InChIKey
YBGQCIYWZSXFLF-UHFFFAOYSA-N
분자식
C19H22N2O4
평균 분자량
342.4 g/mol
단동위원소 질량
342.15795718

이름 및 식별자

우선 이름
Benzaldehyde, 5-(4,5-dihydro-2-oxazolyl)-2-((5-(3-methyl-5-isoxazolyl)pentyl)oxy)-
IUPAC
5-(4,5-dihydro-1,3-oxazol-2-yl)-2-[5-(3-methyl-1,2-oxazol-5-yl)pentoxy]benzaldehyde

이름 및 동의어

105639-13-2Benzaldehyde, 5-(4,5-dihydro-2-oxazolyl)-2-((5-(3-methyl-5-isoxazolyl)pentyl)oxy)-5-(4,5-Dihydrooxazol-2-yl)-2-((5-(3-methylisoxazol-5-yl)pentyl)oxy)benzaldehyde5-{5-[4-(4,5-dihydro-2-oxazolyl)-2-formylphenoxy]pentyl]-3-methylisoxazole5-{5-[4-(4,5-dihydro-2-oxazolyl)-2-formylphenoxy]pentyl}-3-methylisoxazoleBenzaldehyde, 5-(4,5-dihydro-2-oxazolyl)-2-[[5-(3-methyl-5-isoxazolyl)pentyl]oxy]-CHEMBL434050SCHEMBL9862905DTXSID10147238YBGQCIYWZSXFLF-UHFFFAOYSA-N5-(4,5-dihydrooxazol-2-yl)-2-[5-(3-methylisoxazol-5-yl)pentoxy]benzaldehyde5-{5-[2-formyl-4-(4,5-dihydro-2-oxazolyl)phenoxy]pentyl}-3-methylisoxazole
이름 더 보기
5-(4,5-DIHYDRO-1,3-OXAZOL-2-YL)-2-{[5-(3-METHYL-1,2-OXAZOL-5-YL)PENTYL]OXY}BENZALDEHYDE

데이터베이스 식별자

CAS
105639-13-2
PubChem CID
5271233
DTXSID
DTXSID10147238
ChEMBL
CHEMBL434050

물성

구조 계산 물성

XLogP
2.8
극성 표면적
73.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
9
무거운 원자 수
25

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