5',6'-Dihydro-5',5'-dimethyl-8'-(4-methylphenyl)-[2,2'-binaphthalene]6-carboxylic acid

HCID 15870726

기본 정보

표준 SMILES
Cc1ccc(C2=CCC(C)(C)c3ccc(-c4ccc5cc(C(=O)O)ccc5c4)cc32)cc1
InChIKey
UPTRMZKYHBUEHT-UHFFFAOYSA-N
분자식
C30H26O2
평균 분자량
418.5 g/mol
단동위원소 질량
418.19328007

이름 및 식별자

우선 이름
5',6'-Dihydro-5',5'-dimethyl-8'-(4-methylphenyl)-[2,2'-binaphthalene]6-carboxylic acid
IUPAC
6-[5,5-dimethyl-8-(4-methylphenyl)-6H-naphthalen-2-yl]naphthalene-2-carboxylic acid

이름 및 동의어

SCHEMBL6237361UPTRMZKYHBUEHT-UHFFFAOYSA-N5',6'-Dihydro-5',5'-dimeihyl-8'-(4-methylphenyl)-[2,2'-binaphthalene]-6-carboxylic acid5',6'-Dihydro-5',5'-dimethyl-8'-(4-methylphenyl)-[2,2'-binaphthalene]-6-carboxylic Acid5',6'-Dihydro-5',5'-dimethyl-8'-(4-methylphenyl)-[2,2'-binaphthalene]6-carboxylic acid5',6'-Dihydro-5',5'-dimethyl-8'-(4-methylphenyl)-[2.2'-binaphthalene]-6-carboxylic acid

데이터베이스 식별자

PubChem CID
15870726

물성

구조 계산 물성

XLogP
7.8
극성 표면적
37.3 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
2
회전 가능 결합 수
3
무거운 원자 수
32

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