Tributyl(2-phenylethynyl)stannane

HCID 630640CAS 3757-88-8

기본 정보

표준 SMILES: CCC[CH2][Sn]([C]#Cc1ccccc1)([CH2]CCC)[CH2]CCC
InChIKey: PYMPTRMDPJYTDF-UHFFFAOYSA-N
분자식: C20H32Sn
평균 분자량: 391.2 g/mol
단동위원소 질량: 392.15259572

이름 및 식별자

우선 이름: Tributyl(2-phenylethynyl)stannane
IUPAC: tributyl(2-phenylethynyl)stannane
영어명: Phenylethynyltri-n-butyltin
분자식: C20H32Sn
분자량: 391.18

이름 및 동의어

tributyl(2-phenylethynyl)stannaneRefChem:899101628-194-8Tributyl(phenylethynyl)tin3757-88-8Tributyl(phenylethynyl)stannanePhenylethynyltri-n-butyltinStannane, tributyl(phenylethynyl)-PHENYLETHYNYLTRI-N-BUTYLTIN;TRIBUTYL(PHENYLETHYNYL)TIN;(phenylethynyl)tributyltin;Tri-n-butyl(phenylethynyl)tin, 95%;Tributyl(phenylethynyl)tin 95%;tributyl(2-phenylethynyl)Stannane(phenylethynyl)tri-n-butyltintributylstannylphenyl-acetyleneSCHEMBL375615

이름 더 보기

SKL1023(phenylethynyl)tributyltinTributyl(phenylethynyl)tin 95%Tri-n-butyl(phenylethynyl)tin, 95%Tributyl(phenylethynyl)tin - [T5595]PHENYLETHYNYLTRI-N-BUTYLTIN ISO 9001：2015 REACH

tributyl-phenylethynyl-stannaneDTXSID30348129Tributyl(phenylethynyl)stannane #Tributyl(phenylethynyl)tin, 95%tri-n-butyl-phenylethynyl-stannaneAKOS005216804GS-6562DA-42607

데이터베이스 식별자

CAS: 3757-88-8
PubChem CID: 630640
DTXSID: DTXSID30348129
EC Number: 628-194-8
Nikkaji: J329.524I

물성

구조 계산 물성

극성 표면적: 0 Å²
수소 결합 공여자 수: 0
수소 결합 수용자 수: 0
회전 가능 결합 수: 11
무거운 원자 수: 21
형식 전하: 0
복잡도: 291

물리화학적 성질

밀도: 1.116 g/mL · 1.116 g/mL at 25 °C(lit.)
굴절률: 20 · n20/D 1.532(lit.)
인화점: 230 °F · >230 °F
저장 조건: -20 °C · Storage temp. -20°C
물리적 상태: liquid
Specific Gravity: 1.116 · 1.116
InChI: 1S/C8H5.3C4H9.Sn/c1-2-8-6-4-3-5-7-8;3*1-3-4-2;/h3-7H;3*1,3-4H2,2H3;
InChIKey: PYMPTRMDPJYTDF-UHFFFAOYSA-N
SMILES: CCCC[Sn](CCCC)(CCCC)C#Cc1ccccc1

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P264, P264+P265, P270, P273, P280, P301+P316, P302+P352, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, 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.

유해성 정보

Hazard Classes and CategoriesAcute Tox. 3 (100%)

안전 데이터

wgk: 3
tsca: No
ridadr: UN 2788 6.1/PG 3
risk_code: 21-25-36/38-48/23/25-50/53
hazard_code: T,N
safety_code: 35-36/37/39-45-60-61
포장분류: III
위험 등급: 6.1(b)
Hazard Classifications: Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Acute 1Aquatic Chronic 1Eye Irrit. 2Repr. 1BSkin Irrit. 2STOT RE 1
스토리지 클래스: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

응용 분야 · 1건

용도Tributyl(phenylethynyl)tin can be used:As a substrate in the palladium-catalyzed homocoupling oforganostannanes to yield biaryl compounds.To prepare various enynals, which are employed in the synthesis of substituted benzene derivatives catalyzed by nickel.In one of the key synthetic steps for the preparation of β-alkynylcorroles.