4-(Bromomethyl)-2,2-dimethyl-1,3-dioxolane

HCID 169759CAS 36236-76-7

기본 정보

표준 SMILES: CC1(C)OCC(CBr)O1
InChIKey: ZOPZKFNSQYCIPP-UHFFFAOYSA-N
분자식: C6H11BrO2
평균 분자량: 195.05 g/mol
단동위원소 질량: 193.99424169

이름 및 식별자

우선 이름: 4-(Bromomethyl)-2,2-dimethyl-1,3-dioxolane
IUPAC: 4-(bromomethyl)-2,2-dimethyl-1,3-dioxolane
영어명: 4-(Bromomethyl)-2,2-dimethyl-1,3-dioxalane
분자식: C6H11BrO2
분자량: 195.05

이름 및 동의어

4-(bromomethyl)-2,2-dimethyl-1,3-dioxolane36236-76-7DTXSID20957628RefChem:515335DTXCID901385561831-726-34-(Bromomethyl)-2,2-dimethyl-1,3-dioxalaneMFCD145844554-(BROMOMETHYL)-2,2-DIMETHYL-1,3-DIOXOLANDL-Isopropylideneglycerol-1-bromohydrin4-bromomethyl-2,2-dimethyl-1,3-dioxolane2,2-DIMETHYL-4(R)-4-BROMOMETHYL-1,3-DIOXALANE

이름 더 보기

1,3-Dioxalane, 4-(bromomethyl)-2,2-dimethyl-1,3-Dioxolane, 4-(bromomethyl)-2,2-dimethyl-SCHEMBL935837ZOPZKFNSQYCIPP-UHFFFAOYSA-NLBA23676RB3372AKOS016005802CS-W018859

데이터베이스 식별자

CAS: 36236-76-7
PubChem CID: 169759
DTXSID: DTXSID20957628
EC Number: 831-726-3
Nikkaji: J1.598.008G

물성

구조 계산 물성

XLogP: 1.2
극성 표면적: 18.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 2
회전 가능 결합 수: 1
무거운 원자 수: 9
형식 전하: 0
복잡도: 103

물리화학적 성질

끓는 점: 75 ℃ · 75℃ (10 Torr)
밀도: 1.381 g/cm3 · 1.381 g/cm3
굴절률: 1.4597 · 1.4597 (589.3 nm 20℃)
저장 조건: -20 °C · Inert atmosphere,Store in freezer, under -20°C

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H227 (100%): Combustible liquid [Warning Flammable liquids]

P210, P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P333+P317, P362+P364, P370+P378, P403, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.