헥센(시스-3)

cis-3-Hexene

HCID 643783
노트반응
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기본 정보

CAS
7642-09-3
표준 SMILES
CC/C=C\CC
InChIKey
ZQDPJFUHLCOCRG-WAYWQWQTSA-N
분자식
C6H12
평균 분자량
84.16 g/mol
단동위원소 질량
84.09390038

개요

Cis-3-hexene is a 3-hexene in which the double bond adopts a cis-configuration.

이름 및 식별자

우선 이름
cis-3-Hexene
IUPAC
(Z)-hex-3-ene
현지명
헥센(시스-3)
영어명
cis-3-hexene
분자식
C6H12
분자량
84.16

이름 및 동의어

cis-3-Hexene7642-09-3(Z)-3-Hexene(Z)-hex-3-ene(3Z)-3-Hexene3-Hexene, (Z)-(3Z)-hex-3-ene3-hexene, (3Z)-MFCD0008530050181BZ6YTNSC-74124cis-hex-3-ene
이름 더 보기
시스-3-헥센(Z)-3-C6H123-hexene,(Z)-cis-3-Hexene>3-Hexene, (3Z)-cis-3-hexene93+%
(3Z)-3-Hexene #3-HEXENE (CIS)3-HEXENE, CIS-SCHEMBL28935SCHEMBL120668SCHEMBL121614UNII-50181BZ6YTcis-3-Hexene, >=95.0%

데이터베이스 식별자

CAS
7642-09-3
PubChem CID
643783
DTXSID
DTXSID30891266
ChEBI
CHEBI:176792
UNII
50181BZ6YT
EC Number
627-162-0
Nikkaji
J43.521J

물성

구조 계산 물성

XLogP
2.5
극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
0
회전 가능 결합 수
2
무거운 원자 수
6

실험 및 물리화학적 성질

Chemical ClassesOther Classes -> Aliphatics, Unsaturated
SpringerMaterials PropertiesSchoenflies notation
Physical DescriptionLight yellow liquid; [Sigma-Aldrich MSDS]

물리화학적 성질

녹는점
-137.82 °C · -137.82°C
끓는 점
67 °C · 67 °C
밀도
0.677 · 0.677
굴절률
1.3935 · 1.3935-1.3955
인화점
-12 °C · -12 °C
물리적 상태
투명한 액체

화학적 성질

clear colorless to light yellow liquid

안전 및 규제

GHS 분류

GHS Classification · 4건

Danger

H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P264+P265, P280, P301+P316, P303+P361+P353, P305+P351+P338, P331, P337+P317, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 67 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Hazards SummaryAn irritant that may cause severe eye irritation; An aspiration hazard by ingestion (may cause lung damage); [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesFlam. Liq. 2 (100%)

안전 데이터

wgk
3
ridadr
3295
HS 번호
29012990
risk_code
65-11-36
hazard_code
Xn-F,Xn,F
safety_code
62-16-26

화학 및 산업

응용 분야 · 2건

용도cis-3-Hexene is used as an organic chemical synthesis intermediate.

일반 설명cis-3-Hexene is a symmetrical cis-disubstituted alkene that can be prepared by the hydroboration of 3-hexyne followed by protonolysis. The gas-phase study of its molecular structure by electron diffraction combined with molecular mechanical calculations reveals the presence of the (+ac, +ac) and the (-ac, +ac) forms. cis-3-Hexene undergoes epoxidation with dimethyldioxirane to form the corresponding epoxide.

상·하류 제품 정보

공급사34 곳

梯希爱(上海)化成工业发展有限公司021-67121386 · [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]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
추가 설명 · 1건

정의ChEBI: Cis-3-hexene is a 3-hexene in which the double bond adopts a cis-configuration. In this compound, there are two hydrogen atoms on one side and two ethyl groups on the other side of the double bond. The structures of cis-3-hexene and trans-3-hexene in gas phase were determined using electron diffraction and molecular mechanical calculations.

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