1-oxo-3-phenyl-6-(3-phenylpropoxy)-1H-indene-2-carboxylic acid ethyl ester

HCID 11845282

기본 정보

표준 SMILES
CCOC(=O)C1=C(c2ccccc2)c2ccc(OCCCc3ccccc3)cc2C1=O
InChIKey
GRNJWSWEMSYMHQ-UHFFFAOYSA-N
분자식
C27H24O4
평균 분자량
412.5 g/mol

개요

structure in first source

이름 및 식별자

우선 이름
1-oxo-3-phenyl-6-(3-phenylpropoxy)-1H-indene-2-carboxylic acid ethyl ester
IUPAC
ethyl 3-oxo-1-phenyl-5-(3-phenylpropoxy)indene-2-carboxylate

이름 및 동의어

1-oxo-3-phenyl-6-(3-phenylpropoxy)-1H-indene-2-carboxylic acid ethyl ester1-oxo-PPICAEERefChem:907771CHEMBL210162SCHEMBL3572505GRNJWSWEMSYMHQ-UHFFFAOYSA-NEthyl 3-oxo-1-phenyl-5-(3-phenylpropoxy)indene-2-carboxylateBDBM501916121-oxo-3-phenyl-6-(3-phenylpropoxy)-1H-indene-2-carboxylicacid ethyl ester3-phenyl-6-(3-phenylpropyloxy)-1-oxo-1H-indene-2-carboxylate ethyl ester1-Oxo-3-phenyl-6-(3-phenyl-propoxy)-1H-indene-2-carboxylic acid ethyl ester

데이터베이스 식별자

PubChem CID
11845282
ChEMBL
CHEMBL210162
Nikkaji
J2.627.294G

물성

구조 계산 물성

XLogP
5.8
극성 표면적
52.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
4
회전 가능 결합 수
9
무거운 원자 수
31

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15건

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