DL-알파,베타-이소프로필리덴글리세롤-감마-벤질에테르

2,2-Dimethyl-4-((phenylmethoxy)methyl)-1,3-dioxolane

HCID 85795CAS 15028-56-5

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC1(C)OCC(COCc2ccccc2)O1
InChIKey: DBFDSKSLTCMIPB-UHFFFAOYSA-N
분자식: C13H18O3
평균 분자량: 222.28 g/mol
단동위원소 질량: 222.12559444

이름 및 식별자

우선 이름: 2,2-Dimethyl-4-((phenylmethoxy)methyl)-1,3-dioxolane
IUPAC: 2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane
현지명: DL-알파,베타-이소프로필리덴글리세롤-감마-벤질에테르
영어명: 1-Benzyl-2,3-O-isopropylidene glycerol
분자식: C13H18O3
분자량: 222.28

이름 및 동의어

15028-56-54-[(benzyloxy)methyl]-2,2-dimethyl-1,3-dioxolane4-((Benzyloxy)methyl)-2,2-dimethyl-1,3-dioxolane2,2-Dimethyl-4-[(phenylmethoxy)methyl]-1,3-dioxolaneDTXSID3012209252,2-Dimethyl-4-((phenylmethoxy)methyl)-1,3-dioxolaneDTXSID70931897RefChem:1059126DTXCID001447196DTXCID301360597239-110-01-Benzyl-2,3-O-isopropylidene Glycerol

이름 더 보기

DL-알파,베타-이소프로필리덴글리세롤-감마-벤질에테르4-((BENZYLOXY)METHYL)2,2-DIMETHYL2,2-DiMethyl-4-[(phenylMethoxy)Methyl]-1-O-Benzyl-2-O,3-O-isopropylideneglycerol2,2-Dimethyl-4-(benzyloxymethyl)-1,3-dioxolane-2,2-Dimethyl-4-(benzyloxymethyl)-1,3-dioxolane2,2-Dimethyl-4-[(benzyloxy)methyl]-1,3-dioxolane(4S)-Benzyloxymethyl-2,2-dimethyl-[1,3]dioxolane(+-)-4-(benzyloxymethyl)-2,2-*dimethyl-1,3-dioxol(+-)-4-(BENZYLOXYMETHYL)-2,2-DIMETHYL-1, 3-DIOXOLAN

2,2-dimethyl-4-(phenylmethoxymethyl)-1,3-dioxolane4-(Benzyloxymethyl)-2,2-dimethyl-1,3-dioxolane1,3-Dioxolane, 2,2-dimethyl-4-[(phenylmethoxy)methyl]-NSC75108EINECS 239-110-0NSC 7510876189-94-1(4S)-4-(Benzyloxymethyl)-2,2-dimethyl-1,3-dioxolane

데이터베이스 식별자

CAS: 15028-56-5
PubChem CID: 85795
DTXSID: DTXSID301220925
EC Number: 239-110-0
Nikkaji: J241.377I

물성

구조 계산 물성

XLogP: 1.8
극성 표면적: 27.7 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 4
무거운 원자 수: 16
형식 전하: 0
복잡도: 209

물리화학적 성질

끓는 점: 89 · 89-91 °C0.1 mm Hg(lit.)
밀도: 1.051 g/mL · 1.051 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.494(lit.)
인화점: 110 °C · 110 °C
저장 조건: 2 · 2-8°C

안전 및 규제

안전 데이터

wgk: 3
safety_code: 23-24/25
F 고인화성물질: 10-23

화학 및 산업

응용 분야

용도1-Benzyl-2,3-O-isopropylidene Glycerol is used in the preparation of the analogs of dioxolanes Dexoxadrol and Etoxadrol as potential phencyclidine-like agents.