CAS 115754-62-6 Tributyl(1,3-dioxolan-2-ylmethyl)phosphonium Bromide (HCID 22292430)

기본 정보

CAS: 115754-62-6
표준 SMILES: CCCC[P+](CCCC)(CCCC)CC1OCCO1.[Br-]
InChIKey: SABIECHYMHKXJI-UHFFFAOYSA-M
분자식: C16H34BrO2P
평균 분자량: 369.32 g/mol
단동위원소 질량: 368.14797906

이름 및 식별자

우선 이름: Tributyl(1,3-dioxolan-2-ylmethyl)phosphonium Bromide
IUPAC: tributyl(1,3-dioxolan-2-ylmethyl)phosphanium bromide
현지명: (DIOXALAN-2-YL-METHYL)-트리부틸포스포늄브로마이드
영어명: (DIOXALAN-2-YL-METHYL)-TRIBUTYLPHOSPHONIUM BROMIDE
분자식: C16H34BrO2P
분자량: 369.32

이름 및 동의어

Tributyl(1,3-dioxolan-2-ylmethyl)phosphonium BromideRefChem:899096678-328-4115754-62-6((1,3-Dioxolan-2-yl)methyl)tributylphosphonium bromideC16H34BrO2PMFCD09859807Phosphonium, tributyl(1,3-dioxolan-2-ylmethyl)-, bromide (1:1)Tributyl[(1,3-dioxolan-2-yl)methyl]phosphanium bromideSCHEMBL4770077DTXSID60624468tributyl(1,3-dioxolan-2-ylmethyl)phosphanium;bromide

이름 더 보기

(DIOXALAN-2-YL-METHYL)-트리부틸포스포늄브로마이드tributyl(1,3-dioxolan-2-ylmethyl)phosphaniumtributyl(1,3-dioxolan-2-ylmethyl)phosphanium bromidePhosphonium, tributyl(1,3-dioxolan-2-ylmethyl)-, bromide((1,3-Dioxolan-2-yl)methyl)tributylphosphonium bromide - [D88312]

(DIOXALAN-2-YL-METHYL)-TRIBUTYLPHOSPHONIUM BROMIDEAS-71347SY1059901,3-dioxolan-2-ylmethyltributylphosphonium bromideTributyl (1,3-dioxolan-2-ylmethyl)phosphonium bromide, 97%[(1,3-Dioxolan-2-yl)methyl]tributylphosphonium Bromide[(1,3-DioxolanSABIECHYMHKXJI-UHFFFAOYSA-M

물성

구조 계산 물성

극성 표면적: 18.5 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 3
회전 가능 결합 수: 11
무거운 원자 수: 20
형식 전하: 0
복잡도: 193

물리화학적 성질

녹는점: 25 · 25-40 °C
저장 조건: 2 · Inert atmosphere,2-8°C
물리적 상태: powder to lump
색상: 흰색에서 노란색, 주황색으로
InChI: 1S/C16H34O2P.BrH/c1-4-7-12-19(13-8-5-2,14-9-6-3)15-16-17-10-11-18-16;/h16H,4-15H2,1-3H3;1H/q+1;/p-1
InChIKey: SABIECHYMHKXJI-UHFFFAOYSA-M
SMILES: [Br-].CCCC[P+](CCCC)(CCCC)CC1OCCO1

안전 및 규제

GHS 분류

GHS Classification · 4건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.