1-Butynylbenzene

HCID 69328CAS 622-76-4
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
CCC#Cc1ccccc1
InChIKey
FFFMSANAQQVUJA-UHFFFAOYSA-N
분자식
C10H10
평균 분자량
130.19 g/mol
단동위원소 질량
130.07825032

이름 및 식별자

우선 이름
1-Butynylbenzene
IUPAC
but-1-ynylbenzene
영어명
1-Phenyl-1-butyne
분자식
C10H10
분자량
130.19

이름 및 동의어

1-Phenyl-1-butyne622-76-41-ButynylbenzeneBenzene, 1-butynyl-1-Butyne, 1-phenyl-1-Ethyl-2-phenylacetyleneEINECS 210-752-3EthylphenylacetylenePhenylethylacetyleneDTXSID30211243RefChem:75287DTXCID30133734
이름 더 보기
C6H5C≡CC2H5but-1-ynyl-benzene1-Butyn-1-ylbenzene1-(1-Butynyl)benzene1-Phenyl-1-butyne>
210-752-3FFFMSANAQQVUJA-UHFFFAOYSA-NInChI=1/C10H10/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2H2,1Hbut-1-ynylbenzenebut-1-yn-1-ylbenzeneBenzene, 3-butyn-1-yl-MFCD0003994583585-27-7

데이터베이스 식별자

CAS
622-76-4
PubChem CID
69328
DTXSID
DTXSID30211243
EC Number
210-752-3
Nikkaji
J79.758H

물성

구조 계산 물성

XLogP
3.1
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
1
무거운 원자 수
10

실험 및 물리화학적 성질

Kovats Retention Index · 2건

1118；1129；1132.8；1132.3

191.4

물리화학적 성질

끓는 점
73 · 73-75 °C/4 mmHg (lit.)
밀도
0.916 g/mL · 0.916 g/mL at 25 °C (lit.)
굴절률
20 · n20/D 1.551(lit.)
인화점
156 °F · 156 °F
저장 조건
Store at room temperature
물리적 상태
투명한 액체

화학적 성질

Clear colorless liquid

안전 및 규제

GHS 분류

GHS Classification · 5건

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.5%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

유해성 정보

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.5%)

안전 데이터

wgk
3
HS 번호
29029090
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36/37/39
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3

화학 및 산업

응용 분야 · 2건

용도1-Phenyl-1-butyne was used to investigate the liquid-phase stereoselective hydrogenation of phenyl alkyl acetylenics at 298K and atmospheric pressure on Pd-supported catalysts.

일반 설명1-Phenyl-1-butyne is a phenyl alkyl acetylenic compound. It′s reaction with alkali metals (sodium, potassium) in various solvents is reported. Palladium particles incorporated into organophilic montmorillonite catalyzed liquid-phase hydrogenation of 1-phenyl-1-butyne is reported. Copolymerization of C60 and 1-phenyl-1-butyne is reported.

상·하류 제품 정보

공급사50 곳

上海康恩博医药科技有限公司17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

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