4-Methyl-2-pentene, (2Z)-
基本情報
- CAS
4461-48-7- 標準SMILES
C/C=C\C(C)C- InChIKey
LGAQJENWWYGFSN-PLNGDYQASA-N- 分子式
- C6H12
- 平均分子量
- 84.16 g/mol
- 単同位体質量
- 84.09390038
名称と識別子
- 優先名称
- 4-Methyl-2-pentene, (2Z)-
- IUPAC
- (Z)-4-methylpent-2-ene
- 英語名
- cis-4-Methyl-2-pentene
- 分子式
- C6H12
- 分子量
- 84.16
名称と別名
cis-4-Methyl-2-pentene691-38-3(Z)-4-Methyl-2-pentene4-Methyl-cis-2-pentene2-Pentene, 4-methyl-, (Z)-cis-4-Methylpent-2-ene4-Methyl-2-pentene, (2Z)-2-Pentene, 4-methyl-, (2Z)-64K11W5U2TEINECS 211-721-7NSC 73913NSC-73913
名称をさらに表示
CIS-1-ISOPROPYLPROPENEFEMA NO. 4650CIS-2-METHYL-3-PENTENE4-METHYL-2-PENTENE, CIS-2-PENTENE, 4-METHYL-, CIS-4Methylcis2pentenecis4Methylpent2ene(Z)4Methyl2pentene
データベース識別子
- CAS
4461-48-7、691-38-3- PubChem CID
- 5326159
- DTXSID
DTXSID90880651- UNII
- 64K11W5U2T
- EC Number
- 211-721-7
- Nikkaji
- J44.200C
物性
構造計算による物性
- XLogP
- 2.4
- 極性表面積
- 0 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 0
- 回転可能結合数
- 1
- 重原子数
- 6
- 形式電荷
- 0
- 複雑度
- 42
実験および物理化学的性質
Chemical ClassesOther Classes -> Aliphatics, Unsaturated
SpringerMaterials PropertiesBoiling point
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.6690-0.6730
Solubility
Practically insoluble to insoluble
Slightly Soluble (in ethanol)
Boiling Point57-58 °C
Vapor Pressure244.0 [mmHg]
Refractive Index1.3860-1.3900
Physical Description
Clear dark yellow liquid; [Sigma-Aldrich MSDS]
Clear colourless liquid, Fruity green aroma upon dilution
物理化学的性質
- 融点
- -134.8 °C · -134.8 °C
- 沸点
- 56.3 °C · 56.3 °C
安全と法規制
安全情報は参考情報です。供給元の安全データシート（SDS）、適用法令、専門家による評価に代わるものではありません。
GHS分類
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P331, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, 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.
危険有害性情報
Hazards SummaryA skin and strong eye irritant; An aspiration hazard by ingestion (may cause lung injury); [Sigma-Aldrich MSDS] See 2-Methyl-2-pentene, 1-Pentene, 3,4-dimethyl-, and trans-2-Pentene.
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
毒性情報
Adverse EffectsNeurotoxin - Acute solvent syndrome
化学と産業
用途と製造
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
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