化工社化工社 化学情報印刷レポート · 研究参考用
N-メチルブチルアミン
N-メチルブチルアミン · メチルブチルアミン · ブチルメチルアミン · N-ブチルメチルアミン · N-メチルブタン-1-アミン · N-ブチル-N-メチルアミン · N-メチル-1-ブタンアミン · N-メチル-n-ブチルアミン

識別子と物理属性
| CAS No. | 110-68-9 |
|---|---|
| 分子式 | C5H13N |
| 平均分子量 | 87.16 g/mol |
| 単同位体質量 | 87.10479942 g/mol |
| SMILES | CCCCNC |
| InChIKey | QCOGKXLOEWLIDC-UHFFFAOYSA-N |
| PubChem CID | 8068 |
| ChEBI | CHEBI:59019 |
| EC No. | 203-791-2 |
| DTXSID | DTXSID9059389 |
| 現地名 | N-メチルブチルアミン |
化学・物理的性質
| XLogP | 1.3 |
|---|---|
| 極性表面積 | 12 |
| 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 | 3 |
| 重原子数 | 6 |
| 形式電荷 | 0 |
| 複雑度 | 19 |
| LogP(分配係数) | log Kow = 1.33 |
| 密度 | 0.7637 g/cu cm at 15 °C0.7335 @25 °C0.736 g/mL at 25 °C(lit.) |
| Color/Form | Liquid |
| 溶解度 | Miscible in water |
| 引火点 | 55 °F (NFPA, 2010)55 °F (13 °C) (open cup)35 °F |
| 沸点 | 91 °C91 °C @760 [mm Hg]90.5-91.5 °C(lit.) |
| Decomposition | When heated to decomposition it emits toxic fumes of nitroxides. |
| 融点 | Freezing point: -75.0 °C-75 °C |
| 蒸気密度 | 3.0 (AIR= 1) |
| 蒸気圧 | 50.5 [mmHg] |
| Physical Description | N-methylbutylamine appears as a water-white liquid with an ammonia-like odor. Density 0.736 g / cm3 and flash point 35 °F (Aldrich). Vapors heavier than air. Used to make other chemicals.Colorless liquid with an ammonical odor[CAMEO] |
| Dissociation Constants | pKa = 10.9 (conjugate acid) |
| 屈折率 | n20/D 1.3995(lit.) |
| 貯蔵条件 | Store below +30°C. |
| pKa(酸解離定数) | pK1: 10.90(+1) (25°C) |
| 外観・状態 | clear liquid |
| 色 | Colorless to Light orange to Yellow |
| 爆発限界 | 1.3%(V) |
| BRN | 1209231 |
| ヘンリー定数 | 1.3×10-1 mol/(m3Pa) at 25℃, Yaws (2003) |
| InChI | 1S/C5H13N/c1-3-4-5-6-2/h6H,3-5H2,1-2H3/p+1 |
| InChIKey | QCOGKXLOEWLIDC-UHFFFAOYSA-O |
| CAS データベース | 110-68-9(CAS DataBase Reference) |
| EPAの化学物質情報 | 1-Butanamine, N-methyl- (110-68-9) |
化学的特性
CLEAR COLOURLESS LIQUID
安全性と法規制
| GHS 分類 | DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]H311 (89.1%): Toxic in contact with skin [Danger Acute toxicity, dermal]H312 (10.9%): Harmful in contact with skin [Warning Acute toxicity, dermal]H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]H332 (87%): Harmful if inhaled [Warning Acute toxicity, inhalation]P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P362+P364, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 46 reports by companies from 5 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. |
|---|---|
| 規制情報 | Butylmethylamine: Does not have an individual approval but may be used under an appropriate group standardThe 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.) |
| 輸送ラベル(DOT) | Flammable Liquid Corrosive |
| 火災危険 | Excerpt from ERG Guide 132 [Flammable Liquids - Corrosive]:Flammable/combustible material. May be ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along the ground and collect in low or confined areas (sewers, basements, tanks, etc.). Vapor explosion hazard indoors, outdoors or in sewers. Those substances designated with a (P) may polymerize explosively when heated or involved in a fire. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids will float on water. (ERG, 2024)· Flammable/combustible material.· May be ignited by heat, sparks or flames. |
用途
使用
Intermediate.
一般的な説明
A water-white liquid with an ammonia-like odor. Density 0.736 g / cm3 and flash point 35°F (Aldrich) .Vapors heavier than air. Used to make other chemicals.