基本情報
- CAS
565-59-3- 標準SMILES
CCC(C)C(C)C- InChIKey
WGECXQBGLLYSFP-UHFFFAOYSA-N- 分子式
- C7H16
- 平均分子量
- 100.2 g/mol
- 単同位体質量
- 100.12520051
概要
2,3-Dimethylpentane is a hydrocarbon and one of the isomers of heptane. Heptanes may be found in gasoline and are widely used as solvents. They are also sold as fuel for outdoor stoves. (L1289)
名称と識別子
- 優先名称
- 2,3-Dimethylpentane
- IUPAC
- 2,3-dimethylpentane
- 英語名
- 2,3-Dimethylpentane
- 分子式
- C7H16
- 分子量
- 100.2
名称と別名
2,3-DIMETHYLPENTANE565-59-3Pentane, 2,3-dimethyl-3,4-Dimethylpentane8HPD5L8920NSC-23696DTXSID20862203CHEBI:151115RefChem:81863DTXCID90811001209-280-0MFCD00009337
名称をさらに表示
2,3-dimethyl-pentaneEINECS 209-280-0NSC 23696BRN 1718734NSC23696SCHEMBL37523SCHEMBL38394SCHEMBL38395
データベース識別子
- CAS
565-59-3- PubChem CID
- 11260
- DTXSID
DTXSID20862203- UNII
- 8HPD5L8920
- EC Number
- 209-280-0
- Nikkaji
- J43.410H
物性
構造計算による物性
- XLogP
- 3.4
- 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
- 2
- 重原子数
- 7
- 形式電荷
- 0
- 複雑度
- 37.3
実験および物理化学的性質
Chemical ClassesFlammable agents - 3rd degree
SolventsSolvents -> Aliphatics, Saturated (<C12)
SpringerMaterials PropertiesBoiling point
Vapor Pressure68.9 [mmHg]
Physical DescriptionColorless liquid with an odor of gasoline; [NJ-HSFS]
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: Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Danger
H225 (47.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P271, P273, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P319, P321, P331, P332+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
危険有害性情報
Regulatory Information
2,3-Dimethylpentane: Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
Hazards Summary
Causes changes in tubules (including acute renal failure and necrosis) in 4-week intermittent oral studies of rats; [RTECS] An irritant; Inhalation may cause headache, dizziness, and loss of consciousness; Overexposure may cause kidney and nervous system effects; [NJ-HSFS] An irritant; An aspiration hazard by ingestion (may cause lung damage); Inhalation may cause CNS depression; [Acros Organics MSDS]
Hazard Classes and Categories
Flam. Liq. 2 (47.2%)
Flammable liquid - category 2
Flammable agents - 3rd degree
Flam. Liq. 2
安全と保護具
化学と産業
薬理情報
Metabolism/MetabolitesVolatile hydrocarbons are absorbed mainly through the lungs, and may also enter the body after ingestion via aspiration. (A600)
用途と製造
Uses
Used to make other chemicals, in gasoline, rubber solvents, and other petroleum solvents; [NJ-HSFS]
Heptanes may be found in gasoline and are widely used as solvents. They are also sold as fuel for outdoor stoves. (L1289)
Household ProductsInformation on 4 consumer products that contain 2,3-Dimethylpentane in the following categories is provided:
General Manufacturing InformationPentane, 2,3-dimethyl-: ACTIVE
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