CAS 3607-17-8 (3-Bromopropyl)triphenylphosphonium bromide (HCID 2723862)

부분 구조 검색 유사 구조 찾기

기본 정보

CAS: 3607-17-8
표준 SMILES: BrCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChIKey: ZAHUZZUGJRPGKW-UHFFFAOYSA-M
분자식: C21H21Br2P
평균 분자량: 464.2 g/mol
단동위원소 질량: 461.9747615

개요

structure given in first source

이름 및 식별자

우선 이름: (3-Bromopropyl)triphenylphosphonium bromide
IUPAC: 3-bromopropyl(triphenyl)phosphanium bromide
영어명: (3-Bromopropyl)triphenylphosphonium bromide
분자식: C21H21Br2P
분자량: 464.17

이름 및 동의어

(3-Bromopropyl)triphenylphosphonium bromide3607-17-83-(Bromopropyl)triphenylphosphoniumBrPTPPRefChem:570285222-770-93-Bromopropyltriphenylphosphonium BromideC21H21Br2PMFCD000118663-bromopropyl(triphenyl)phosphanium;bromide3-bromopropyl(triphenyl)phosphonium;bromide(3-BROMOPROPYL)TRIPHENYLPHOSPHONIUMBROMIDE

이름 더 보기

3-bromopropyl(triphenyl)phosphaniumBROMOPROPYLTRIPHENYLPHOSPHONIUM BROMIDEbromo(3-bromopropyl)triphenylphosphorane(3-bromopropyl)triphenylphosphanium bromide(3-Bromopropyl) Triphenyl Phosphorus Bromide3-Bromopropyltriphenylphosphonium Bromide >

NSC84074Olopatadine Impurity 35(3-bromopropyl) triphenylphosphonium bromide(3-Bromo-propyl)-triphenyl-phosphonium bromideNSC 84074Bromo(3-bromopropyl)triphenylphosphorus(3-Bromopropyl)triphenylphosphonium Bromide; NSC 84074;Phosphonium, (3-bromopropyl)triphenyl-, bromide

데이터베이스 식별자

CAS

물성

구조 계산 물성

극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 1
회전 가능 결합 수: 6
무거운 원자 수: 24
형식 전하: 0
복잡도: 279

물리화학적 성질

녹는점: 228 · 228-230 °C(lit.)
저장 조건: Inert atmosphere,Room Temperature
용해도: 클로로포름, 메탄올에 용해됨
물리적 상태: 고체
색상: 하얀색
BRN: 6422974 · 6422974
InChI: InChI=1S/C21H21BrP.BrH/c22-17-10-18-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18H2;1H/q+1;/p-1
InChIKey: ZAHUZZUGJRPGKW-UHFFFAOYSA-M
SMILES: [P+](CCCBr)(C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1.[Br-]

화학적 성질

WHITE TO OFF-WHITE CRYSTALLINE POWDER

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 45 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.