2-エチルブチルアミン

2-エチルブチルアミン · (2-エチルブチル)アミン · 2-エチル-N-ブチルアミン · 3-(アミノメチル)ペンタン · 2-ETHYLBUTYLAMINE · 2-ethyl-butylamin · 2-ethyl-1-butanamin · 2-ETHYL-N-BUTYLAMINE

https://huagongshe.com/ja/chemical/12049

識別子と物理属性

CAS No.	617-79-8
分子式	C6H15N
平均分子量	101.19 g/mol
単同位体質量	101.12044948 g/mol
SMILES	CCC(CC)CN
InChIKey	MGWAGIQQTULHGU-UHFFFAOYSA-N
PubChem CID	12049
EC No.	210-530-6
DTXSID	DTXSID00210703
現地名	2-エチルブチルアミン

化学・物理的性質

XLogP	1.3
極性表面積	26
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	7
形式電荷	0
複雑度	31.2
物質分類	Nitrogen Compounds -> Amines, Aliphatic
臭い	Amine odor
密度	0.776 @ 20 °C/20 °C
Color/Form	Water-white liquid
溶解度	Soluble in methyl and ethyl alcohols, ethyl ether, ethyl acetate, acetone, aromatic and aliphatic hydrocarbons, fixed oils, mineral oil, oleic and stearic acids.Chloroform (Sparingly), DMSO (Slightly)25°C で水に可溶 3.83E+04 mg/L。
沸点	125 °C
Decomposition	When heated to decomposition it emits toxic fumes of nitroxides.
蒸気密度	3.49 (AIR= 1)
蒸気圧	15.0 [mmHg]
Physical Description	Colorless liquid with an amine odor[HSDB] Colorless liquid or low melting solidmp = 20-23 deg C[MSDSonline]
Other Experimental Properties	1 MG/L= 242 PPM1 PPM= 4.14 MG/CU M
融点	20°C
屈折率	1.4100
引火点	14 °C
貯蔵条件	Flammables area
外観・状態	liquid
pKa（酸解離定数）	10.75±0.10(Predicted)
色	Colourless
ヘンリー定数	1.8×10-1 mol/(m3Pa) at 25℃, Yaws (2003)
InChI	InChI=1S/C6H15N/c1-3-6(4-2)5-7/h6H,3-5,7H2,1-2H3
InChIKey	MGWAGIQQTULHGU-UHFFFAOYSA-N
SMILES	C(N)C(CC)CC
CAS データベース	617-79-8(CAS DataBase Reference)

化学的特性

clear colorless to light yellow liquid

安全性と法規制

GHS 分類	DangerH225 (66.7%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P321, P330, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 6 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
火災の可能性	A very dangerous fire hazard when exposed to heat or flame ...
有害性の概要	Flammable liquid[Hawley] A skin and severe eye irritant[SAX] External application to rabbit eyes scored 9 on a scale of 1-10 (10 being most severe) for degree of injury after 24 hoursEmergency treatment: Irritants[HSDB] A corrosive substance that can cause injury to the skin, eyes, and respiratory tractMay be absorbed through skinInhalation may result in chemical pneumonitis[MSDSonline]
Hazard Classes and Categories	Acute Tox. 4 (100%)
Skin, Eye, and Respiratory Irritations	A skin and severe eye irritant.
Hazardous Reactivities and Incompatibilities	... Can react with oxidizing materials.
消火手順	To fight fire, use dry chemical, carbon dioxide, foam.
処分方法	SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
Preventive Measures	SRP: The scientific literature for the use of contact lenses in industry is conflicting. The benefit or detrimental effects of wearing contact lenses depend not only upon the substance, but also on factors including the form of the substance, characteristics and duration of the exposure, the uses of other eye protection equipment, and the hygiene of the lenses. However, there may be individual substances whose irritating or corrosive properties are such that the wearing of contact lenses would be harmful to the eye. In those specific cases, contact lenses should not be worn. In any event, the usual eye protection equipment should be worn even when contact lenses are in place.

用途

使用

2-Ethylbutylamine is used in preparation of Amide-substituted Heterocyclic compounds for the treatment of conditions related to the modulation of IL-12, IL-23 and/or IFN-alpha.