Ethyl 4-[(5,5-dimethyl-8-(carbethoxymethyl)-5,6-dihydronaphthalen-2-yl)azo]benzoate

HCID 22571504

기본 정보

표준 SMILES
CCOC(=O)CC1=CCC(C)(C)c2ccc(N=Nc3ccc(C(=O)OCC)cc3)cc21
InChIKey
JVGISWYRBBMKME-UHFFFAOYSA-N
분자식
C25H28N2O4
평균 분자량
420.5 g/mol

이름 및 식별자

우선 이름
Ethyl 4-[(5,5-dimethyl-8-(carbethoxymethyl)-5,6-dihydronaphthalen-2-yl)azo]benzoate
IUPAC
ethyl 4-[[8-(2-ethoxy-2-oxoethyl)-5,5-dimethyl-6H-naphthalen-2-yl]diazenyl]benzoate

이름 및 동의어

SCHEMBL6292931SCHEMBL6292933JVGISWYRBBMKME-UHFFFAOYSA-N1Ethyl 4-[(5,5-dimethyl-8-(carbethoxymethyl)-5,6-dihydronaphthalen-2-yl)azo]benzoateEthyl 4-[(5,5-dimethyl-8(carbethoxymethyl)-5,6-dihydronaphthalen-2-yl)azo]benzoateEthyl 4-[(5,5-dimethyl-8-(carbethoxymethyl) -5,6-dihydronaphthalen-2-yl)azo]benzoateEthyl 4-[(5,5-dimethyl-8-(carbethoxymethyl)-5,6-dihydronaphthalen-2-yl)azo]benzoateEthyl 4-[(5,5-dimethyl-8-(carbethoxymethyl)-5,6-dihydronaphthalen-2yl)azo]benzoate

데이터베이스 식별자

PubChem CID
22571504

물성

구조 계산 물성

XLogP
5.6
극성 표면적
77.3 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
9
무거운 원자 수
31

관련 반응

15건

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