基本情報
- CAS
108-09-8- 標準SMILES
CC(C)CC(C)N- InChIKey
UNBMPKNTYKDYCG-UHFFFAOYSA-N- 分子式
- C6H15N
- 平均分子量
- 101.19 g/mol
- 単同位体質量
- 101.12044948
概要
1,3-dimethylbutylamine appears as a liquid with a fishlike odor. Less dense than water. Flash point 39 - 55 °F. Vapors heavier than air. May be toxic by ingestion, inhalation and skin absorption.
名称と識別子
- 優先名称
- 1,3-Dimethylbutylamine
- IUPAC
- 4-methylpentan-2-amine
- 現地名
- 1,3-ジメチルブチルアミン
- 英語名
- 1,3-Dimethylbutylamine
- 分子式
- C6H15N
- 分子量
- 101.19
名称と別名
1,3-DIMETHYLBUTYLAMINE108-09-82-Amino-4-methylpentane4-Methyl-2-aminopentane1,3-DimethylbutanamineButylamine, 1,3-dimethyl-1,3-Dimethyl butylamine4-amino-2-methylpentane4-amino-2-pentanamineDTXSID4025113KXP599H5R6NSC-48080
名称をさらに表示
1,3-ジメチルブチルアミン2-アミノ-4-メチルペンタン4-メチル-2-ペンタンアミン4-メチルペンタン-2-アミン1,3‐ジメチルブチルアミンRARECHEM AN KC 0202TIMTEC-BB SBB0066711,3-Dimethylbutylamin4-methyl-2-pentanamin4-Methyl-2-pentylamin1,3-dimethyl-butylamin4-Methyl-2-aminopentan4-Methyl-2-pentanamine
J35.117BDTXCID205113DL-1,3-DIMETHYLBUTYLAMINERefChem:72728203-549-64-methylpentan-2-amine2-Pentanamine, 4-methyl-(1,3-Dimethylbutyl)amine
データベース識別子
- CAS
108-09-8
物性
構造計算による物性
- XLogP
- 1.4
- 極性表面積
- 26 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 1
- 回転可能結合数
- 2
- 重原子数
- 7
- 形式電荷
- 0
- 複雑度
- 41.4
実験および物理化学的性質
Chemical ClassesFlammable agents - 3rd degree
Density0.75 at 68 °F (NTP, 1992) - Less dense than water; will float
Flash Point55 °F (NTP, 1992)
Boiling Point223 to 228 °F at 760 mmHg (NTP, 1992)
Physical Description1,3-dimethylbutylamine appears as a liquid with a fishlike odor. Less dense than water. Flash point 39 - 55 °F. Vapors heavier than air. May be toxic by ingestion, inhalation and skin absorption.
物理化学的性質
- 融点
- -40.7 °C · -40.7°C (estimate)
- 沸点
- 108 · 108-110 °C(lit.)
- 比重(密度)
- 0.717 g/mL · 0.717 g/mL at 25 °C(lit.)
- 屈折率
- 20 · n20/D 1.4085(lit.)
- 闪点
- 55 °F · 55 °F
- 貯蔵温度
- Flammables area
- 溶解性
- Chloroform (Sparingly), Ethyl Acetate (Slightly)
- 外見
- 液体
- 酸解離定数(Pka)
- 11.07 · 11.07±0.42(Predicted)
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, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory InformationThe 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.)
DOT LabelFlammable Liquid Corrosive
Fire Hazards
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
· Flammable/combustible material.
Health Hazards
Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:
· May cause toxic effects if inhaled or ingested.
DOT ID and Guide2379 132
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity AlertsHighly Flammable
Reactivity Profile
1,3-DIMETHYLBUTYLAMINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.
化学と産業
用途と製造
General Manufacturing Information2-Pentanamine, 4-methyl-: ACTIVE
応用分野
使用1,3-Dimethylbutylamine has been used to study the application of unfunctionized polymethacrylate resin (TSKgel G3000PWXL) as a stationary phase in liquid chromatography with UV detection.
一般的な説明A liquid with a fishlike odor. Less dense than water. Flash point 39 - 55°F. Vapors heavier than air. May be toxic by ingestion, inhalation and skin absorption.
サプライヤー43 社
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]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Aladdin Scientific[email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
関連反応
2 件
化合物ノート
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