基本情報
- 標準SMILES
CCCCC(CC)CNCC(CC)CCCC- InChIKey
SAIKULLUBZKPDA-UHFFFAOYSA-N- 分子式
- C16H35N
- 平均分子量
- 241.46 g/mol
- 単同位体質量
- 241.27695012
概要
2,2'-diethylhexylamine is a clear colorless liquid with a slight ammonia-like odor. (NTP, 1992)
名称と識別子
- 優先名称
- Bis(2-ethylhexyl)amine
- IUPAC
- 2-ethyl-N-(2-ethylhexyl)hexan-1-amine
- 現地名
- ジ(2-エチルヘキシル)アミン
- 英語名
- Bis(2-ethylhexyl)amine
- 分子式
- C16H35N
- 分子量
- 241.46
名称と別名
名称をさらに表示
データベース識別子
- CAS
106-20-7、27214-52-4- PubChem CID
- 7791
- DTXSID
DTXSID7025053- ChEMBL
CHEMBL1330355- ChEBI
CHEBI:193588- UNII
- 9U5Q5UV6DB
- EC Number
- 203-372-4、248-331-1
- Nikkaji
- J27.961G
物性
構造計算による物性
- XLogP
- 6.1
- 極性表面積
- 12 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
- 12
- 重原子数
- 17
- 形式電荷
- 0
- 複雑度
- 128
実験および物理化学的性質
Cosmetics
Personal care product
Antistatic; Hair conditioning
Flash Point
270 °F (NTP, 1992)
270 °F
Vapor Pressure
0.01 mmHg at 68 °F (NTP, 1992)
0.01 [mmHg]
Physical Description
2,2'-diethylhexylamine is a clear colorless liquid with a slight ammonia-like odor. (NTP, 1992)
Liquid
Clear colorless liquid with a slight ammonia-like odor; [CAMEO]
物理化学的性質
- 融点
- -60 °C · -60 °C
- 沸点
- 123 °C5 · 123 °C5 mm Hg(lit.)
- 比重(密度)
- 0.805 g/mL · 0.805 g/mL at 25 °C(lit.)
- 蒸気圧
- 0.0023 hPa · 0.0023 hPa (20 °C)
- 屈折率
- 20 · n20/D 1.443(lit.)
- 闪点
- 230 °F · >230 °F
- 貯蔵温度
- 30 °C · Store below +30°C.
- 溶解性
- 0.014 g/リットル · 0.014g/リットル
- 酸解離定数(Pka)
- 40 · 40(at 25℃)
- 外見
- 液体
- 色
- 無色透明~微黄色透明
- 比重
- 0.804 · 0.804 (20/4℃)
- PH
- 7 · >7 (H2O, 20℃)
- 爆発限界(explosive limit)
- 0.6 · 0.6-3.7%(V)
- 水溶解度
- 0.2 g/L · <0.2 g/L (20 °C)
- BRN
- 1748342 · 1748342
- 安定性
- 安定。可燃性。酸化剤と相容れない。
- 化粧品成分の機能
- 帯電防止
- InChI
- 1S/C16H35N/c1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2/h15-17H,5-14H2,1-4H3
- InChIKey
- SAIKULLUBZKPDA-UHFFFAOYSA-N
- SMILES
- CCCCC(CC)CNCC(CC)CCCC
- LogP
- 7.3 at · 7.3 at 25℃
- CAS データベース
- 106 · 106-20-7(CAS DataBase Reference)
- NISTの化学物質情報
- 1 · 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-(106-20-7)
- EPAの化学物質情報
- Di(2-ethylhexyl)amine (106-20-7)
化学的性質
化学的特性colourless liquid
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 0.1% (1 of 669) of reports.
Danger
H302+H312 (65.9%): Harmful if swallowed or in contact with skin [Warning Acute toxicity, oral; acute toxicity, dermal]
P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 669 reports by companies from 17 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Not Classified
危険有害性情報
Regulatory Information
Chemical: 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-
1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 13-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/5450
Bis(2-ethylhexyl) amine: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
2,2'-DIETHYLHEXYLAMINE can react with oxidizing materials (NTP, 1992). 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.
安全と保護具
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with ethanol followed by washing with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
毒性情報
安全データ
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- IH6825000
- ridadr
- UN 2735 8/PG 2
- 毒性
- LD50 orally in Rabbit: 1008 mg/kg LD50 dermal Rabbit 956 mg/kg
- hs_code
- 29211980
- risk_code
- 21/22-34
- 化審法
- (2)-176, (2)-133
- 消防法
- 危-4-3-III
- hazard_code
- C,Xi
- hazard_note
- Irritant/Corrosive
- safety_code
- 26-36/37/39-45-36
- hazard_class
- 8
- packing_group
- III
- 自然発火温度
- 230 °C
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 4 OralAquatic Chronic 1Eye Dam. 1Skin Corr. 1B
- ストレージクラス
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
化学と産業
用途と製造
General Manufacturing Information
Petroleum Lubricating Oil and Grease Manufacturing
1-Hexanamine, 2-ethyl-N-(2-ethylhexyl)-: ACTIVE
応用分野
用途染料原料、乳化剤
用途染料?農薬?乳化剤?触媒?医薬原料
使用Bis(2-ethylhexyl)amine (BEA) was used in the synthesis of stable nanosized CdS particles coated by an oriented monolayer of chemically bonded BEA molecules
一般的な説明Clear colorless liquid with a slight ammonia-like odor.
上流・下流製品情報
上流原料
下流製品
サプライヤー50 社
補足説明
定義本品は、次の化学式で表されるジアルキルアミンである。
関連反応
関連ノート
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