뷰틸트리페닐포스포니움 브롬화물

Butyltriphenylphosphonium bromide

HCID 159628CAS 1779-51-7

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]
InChIKey: IKWKJIWDLVYZIY-UHFFFAOYSA-M
분자식: C22H24P.Br
평균 분자량: 399.3 g/mol
단동위원소 질량: 398.0798995

이름 및 식별자

우선 이름: Butyltriphenylphosphonium bromide
IUPAC: butyl(triphenyl)phosphanium bromide
현지명: 뷰틸트리페닐포스포니움 브롬화물
영어명: Butyltriphenylphosphonium bromide
분자식: C22H24BrP
분자량: 399.3

이름 및 동의어

Butyltriphenylphosphonium bromide1779-51-7N-Butyltriphenylphosphonium bromidePhosphonium, butyltriphenyl-, bromidePhosphonium, butyltriphenyl-, bromide (1:1)NSC-5968497KU95HRS8DTXSID90883581B-0970RefChem:862299DTXCID201023097217-219-4

이름 더 보기

n-부틸트리페닐포스포늄브로마이드부틸트리페닐포스포니움브롬화물뷰틸트리페닐포스포니움브롬화물뷰틸트리페닐포스포니움브롬화물(BUTYLTRIPHENYLPHOSPHONIUMBROMIDE)BTPPBBuTPPBrTriphenylbutylphosphonium bromideNSC 59684Butyltripheny(o-Boric Acid)(1-BUTYL)TRIPHENButyl triphenyl phoButyltriphenylphosph

(1-Butyl)Triphenylphosphonium Bromidebutyl(triphenyl)phosphanium;bromidebutyl(triphenyl)phosphonium bromideC22H24BrPMFCD00011855NSC59684btppbrbutyl triphenyl phosphine bromide

데이터베이스 식별자

CAS: 1779-51-7
PubChem CID: 159628
DTXSID: DTXSID90883581
ChEMBL: CHEMBL4792223
UNII: 97KU95HRS8
EC Number: 217-219-4、918-205-7

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: 273

물리화학적 성질

녹는점: 240 · 240-243 °C(lit.)
저장 조건: Inert atmosphere,Room Temperature
용해도: 클로로포름, 메탄올에 용해됨
물리적 상태: 결정성 분말
색상: 하얀색
수용성: 녹는
BRN: 3580224 · 3580224
InChI: InChI=1S/C22H24P.BrH/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,2-3,19H2,1H3;1H/q+1;/p-1
InChIKey: IKWKJIWDLVYZIY-UHFFFAOYSA-M
SMILES: [P+](CCCC)(C1C=CC=CC=1)(C1C=CC=CC=1)C1=CC=CC=C1.[Br-]
EPA: Phosphonium, butyltriphenyl-, bromide (1779-51-7)

화학적 성질

white crystalline powder

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (82.3%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 226 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 4건

Chemical: Phosphonium, butyltriphenyl-, bromide

PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Status: Active Update: 25-06-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/21687

Phosphonium, butyltriphenyl-, bromide: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesAcute Tox. 3 (82.3%)