디 -tert- 부틸 클로로 포스 핀

Di-tert-butylchlorophosphine

HCID 139566CAS 13716-10-4

부분 구조 검색 유사 구조 찾기

기본 정보

표준 SMILES: CC(C)(C)P(Cl)C(C)(C)C
InChIKey: MCRSZLVSRGTMIH-UHFFFAOYSA-N
분자식: C8H18ClP
평균 분자량: 180.65 g/mol
단동위원소 질량: 180.08346489

이름 및 식별자

우선 이름: Di-tert-butylchlorophosphine
IUPAC: ditert-butyl(chloro)phosphane
현지명: 디 -tert- 부틸 클로로 포스 핀
영어명: Di-tert-butylchlorophosphane
분자식: C8H18ClP
분자량: 180.66

이름 및 동의어

Di-tert-butylchlorophosphine13716-10-4Phosphinous chloride, bis(1,1-dimethylethyl)-Chlorodi-tert-butylphosphinePhosphinous chloride, di-tert-butyl-Di-tert-Butylphosphinous chloride(tert-C4H9)2PClDTXSID70160089RefChem:132522DTXCID9082580604-003-3MCRSZLVSRGTMIH-UHFFFAOYSA-N

이름 더 보기

디-tert-부틸클로로포스핀Di-t-butyLAURORA KA-131998% [(CH3)3C]2PClDI-TERT-BUTYLCHLOROPHOPhosphonous dichloride

Di-tert-butylchlorophosphanedi-t-Butylchlorophosphineditert-butyl(chloro)phosphaneClPtBu2MFCD00008815Phosphinous chloride, P,P-bis(1,1-dimethylethyl)-P(tBu)2Cl(Me3C)2P-Cl

데이터베이스 식별자

CAS: 13716-10-4
PubChem CID: 139566
DTXSID: DTXSID70160089
EC Number: 604-003-3
Nikkaji: J101.881G

물성

구조 계산 물성

XLogP: 2.7
극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 2
무거운 원자 수: 10
형식 전하: 0
복잡도: 93.4

실험 및 물리화학적 성질

SpringerMaterials PropertiesSchoenflies notation

물리화학적 성질

녹는점: 2 · 2-3°C
끓는 점: 48 °C/3 · 48 °C/3 mmHg (lit.)
밀도: 0.951 g/mL · 0.951 g/mL at 25 °C (lit.)
굴절률: 20 · n20/D 1.482(lit.)
인화점: 142 °F · 142 °F
용해도: 테라히드로푸란과 혼합 가능.
물리적 상태: 액체
Specific Gravity: 0.951 · 0.951
색상: 무색의
InChI: InChI=1S/C8H18ClP/c1-7(2,3)10(9)8(4,5)6/h1-6H3
InChIKey: MCRSZLVSRGTMIH-UHFFFAOYSA-N
SMILES: P(C(C)(C)C)(C(C)(C)C)Cl
NIST: Phosphinous chloride, bis(1,1-dimethylethyl)-(13716-10-4)

화학적 성질

Colorless to light yellow liqui

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 48 reports by companies from 5 notifications to the ECHA C&L Inventory.

유해성 정보

Hazard Classes and CategoriesSkin Corr. 1B (100%)

안전 데이터

wgk: 3
tsca: No
ridadr: UN 3265 8/PG 2
HS 번호: 29310099
risk_code: 34
hazard_code: C
safety_code: 26-36/37/39-45-25
포장분류: II
위험 등급: 8
Hazard Classifications: Skin Corr. 1B
스토리지 클래스: 8A - Combustible corrosive hazardous materials

화학 및 산업

응용 분야 · 1건

용도Di-tert-butylchlorophosphine is associated with palladium(II) acetate and used in Suzuki-Miyaura cross-couplings of arylboronic acids with aryl bromides and chlorides. It serves as a ligand and used in the preparation of mono- and bidentate phosphine ligands in metal complexes for catalytic chiral asymmetric hydrogenations. Further, it is used in asymmetric and transition metal coupling reactions. In addition to this, it plays an important role in the preparation of other phosphines in catalytic polymerization reactions.

공급사50 곳

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