Tert-butyl 2-[6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
기본 정보
- 표준 SMILES
CC(C)(C)OC(=O)CC1CC(CO)OC(C)(C)O1- InChIKey
CFRUAOXMCVQMFP-UHFFFAOYSA-N- 분자식
- C13H24O5
- 평균 분자량
- 260.33 g/mol
이름 및 식별자
- 우선 이름
- Tert-butyl 2-[6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
- IUPAC
- tert-butyl 2-[6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate
이름 및 동의어
148809-28-3SCHEMBL5728730CFRUAOXMCVQMFP-UHFFFAOYSA-Ntert-butyl 2-[6-(hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetate(4S,6R)-6-HydroxyMethyl-2,2-diMethyl-1,3-dioxane-4-acetic Acid, 1,1-DiMethylethyl Ester(6-hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4-yl)-acetic acid tert-butyl ester((4R,6S)-6-Hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4-yl)acetic acid tert-butyl ester; (6S-Hydroxymethyl-2,2-dimethyl-[1,3]dioxan-4R-yl)acetic acid tert-butyl ester; 2-[(4R,6S)-6-(Hydroxymethyl)-2,2-dimethyl-1,3-dioxan-4-yl]acetic acid tert-butyl ester
데이터베이스 식별자
- PubChem CID
- 15614600
물성
구조 계산 물성
- XLogP
- 1
- 극성 표면적
- 65 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 292
관련 반응
4건
화합물 노트
불러오는 중…