Ethyl 3-(3-(naphthalen-1-yloxy)propyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indole-2-carboxylate

HCID 68940461CAS 1073493-76-1

기본 정보

표준 SMILES
CCOC(=O)c1[nH]c2c(B3OC(C)(C)C(C)(C)O3)cccc2c1CCCOc1cccc2ccccc12
InChIKey
MMJMENWIYROGLC-UHFFFAOYSA-N
분자식
C30H34BNO5
평균 분자량
499.4 g/mol
단동위원소 질량
499.2530034

이름 및 식별자

우선 이름
Ethyl 3-(3-(naphthalen-1-yloxy)propyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indole-2-carboxylate
IUPAC
ethyl 3-(3-naphthalen-1-yloxypropyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-2-carboxylate

이름 및 동의어

1073493-76-1ethyl 3-(3-(naphthalen-1-yloxy)propyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indole-2-carboxylate(2-(Ethoxycarbonyl)-3-(3-(naphthalen-1-yloxy)propyl)-1H-indol-7-yl)boronic acid pinacol esterSCHEMBL4168839SCHEMBL29602387MMJMENWIYROGLC-UHFFFAOYSA-NDTXSID601108908Ethyl 3-[3-(1-naphthalenyloxy)propyl]-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-2-carboxylateethyl3-(3-(naphthalen-1-yloxy)propyl)-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-indole-2-carboxylate

데이터베이스 식별자

CAS
1073493-76-1
PubChem CID
68940461
DTXSID
DTXSID601108908

물성

구조 계산 물성

극성 표면적
69.8 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
5
회전 가능 결합 수
9
무거운 원자 수
37

관련 반응

6건

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