기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)C(c1ccc(CBr)cc1)C1CCCC1- InChIKey
VQOWAMGSDNVFCV-UHFFFAOYSA-N- 분자식
- C18H25BrO2
- 평균 분자량
- 353.3 g/mol
이름 및 식별자
- 우선 이름
- tert-Butyl 2-(4-(bromomethyl)phenyl)-2-cyclopentylacetate
- IUPAC
- tert-butyl 2-[4-(bromomethyl)phenyl]-2-cyclopentylacetate
이름 및 동의어
157312-16-8tert-Butyl 2-(4-(bromomethyl)phenyl)-2-cyclopentylacetatetert-butyl 2-[4-(bromomethyl)phenyl]-2-cyclopentylacetateSCHEMBL1179036VQOWAMGSDNVFCV-UHFFFAOYSA-NDB-110173F51778tert-butyl [4-(bromomethyl)phenyl](cyclopentyl)acetatetert-butyl[4-(bromomethyl)phenyl](cyclopentyl)acetatetertbutyl 2-(4-bromomethylphenyl)-2-cyclopentylacetatetert-butyl 2-(4-bromomethylphenyl)-2-cyclopentyl-acetatetert-butyl 2-(4-bromomethylphenyl)-2-cyclopentylacetate
이름 더 보기
tert-Butyl 2-(4-bromomethyl-phenyl)-2-cyclopentyl-acetatetert-Butyl2-(4-(bromomethyl)phenyl)-2-cyclopentylacetatetert-butyl(+/-)-[4-(bromomethyl)phenyl](cyclopentyl)acetatetert-butyl(+/-)-2-(4-(bromomethyl)phenyl)-2-cyclopentylacetate
데이터베이스 식별자
- PubChem CID
- 15225592
물성
구조 계산 물성
- XLogP
- 5.5
- 극성 표면적
- 26.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 2
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 21
- 형식 전하
- 0
- 복잡도
- 334
관련 반응
30건
화합물 노트
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