Ethyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethylnaphth-3-yl)ethynyl]benzoate

HCID 3025972

기본 정보

표준 SMILES
CCOC(=O)c1ccc(C#Cc2ccc3c(c2)C(O)CCC3(C)C)cc1
InChIKey
RKAVXDSAMZQAFH-UHFFFAOYSA-N
분자식
C23H24O3
평균 분자량
348.4 g/mol

이름 및 식별자

우선 이름
Ethyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethylnaphth-3-yl)ethynyl]benzoate
IUPAC
ethyl 4-[2-(8-hydroxy-5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)ethynyl]benzoate

이름 및 동의어

SCHEMBL7636118RKAVXDSAMZQAFH-UHFFFAOYSA-NEthyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethyl-naphth-3-yl)ethynyl]benzoateEthyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethylnaphth-3-yl ) ethynyl]benzoateEthyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethylnaphth-3-yl)ethynyl]benzoate

데이터베이스 식별자

PubChem CID
3025972

물성

구조 계산 물성

XLogP
4.9
극성 표면적
46.5 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
3
회전 가능 결합 수
5
무거운 원자 수
26

관련 반응

11건

연결된 노트

불러오는 중…

Ethyl 4-[(5,6,7,8-tetrahydro-5-hydroxy-8,8-dimethylnaphth-3-yl)ethynyl]benzoate (HCID 3025972)|Huagongshe