トリヘキシルアミン [イオン対試薬]
Trihexylamine
データを補完しています。しばらくしてからページを更新すると最新の内容を表示できます
基本情報
- CAS
102-86-3- 標準SMILES
CCCCCCN(CCCCCC)CCCCCC- InChIKey
DIAIBWNEUYXDNL-UHFFFAOYSA-N- 分子式
- C18H39N
- 平均分子量
- 269.5 g/mol
- 単同位体質量
- 269.30825025
名称と識別子
- 優先名称
- Trihexylamine
- IUPAC
- N,N-dihexylhexan-1-amine
- 現地名
- トリヘキシルアミン [イオン対試薬]
- 英語名
- TRI-N-HEXYLAMINE
- 分子式
- C18H39N
- 分子量
- 269.51
名称と別名
TrihexylamineTri-n-hexylamine1-Hexanamine, N,N-dihexyl-N,N-dihexylhexan-1-amineN,N-Dihexyl-1-hexanamineAMINE,TRIHEXYLUNII-A9392WA249EINECS 203-062-9A9392WA249NSC 409786NSC-409786AI3-16575
名称をさらに表示
トリヘキシルアミントリヘキシルアミン [イオン対試薬]1,1',1''-ニトリロトリヘキサントリ-N-ヘキシルアミンN-TRIHEXYLAMINETrihexylamine,98%TrihexylaMine 96%Trihexylamine >Tri(hex-1-yl)amineTri-n-hexylamineHPLCn,n-dihexyl-1-hexanamin
DTXSID80592631Hexanamine, N,NdihexylRefChem:191671DTXCID1032692203-062-9DIAIBWNEUYXDNL-UHFFFAOYSA-NInChI=1/C18H39N/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h4-18H2,1-3H102-86-3
データベース識別子
- CAS
102-86-3、68038-01-7- PubChem CID
- 66022
- UNII
- A9392WA249
- EC Number
- 203-062-9
- Nikkaji
- J121.782H
物性
構造計算による物性補完中
- XLogP
- 7.3
- 極性表面積
- 3.2 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 1
- 回転可能結合数
- 15
- 重原子数
- 19
- 形式電荷
- 0
- 複雑度
- 127
実験および物理化学的性質
Physical DescriptionLiquid; [Alfa Aesar MSDS]
Kovats Retention Index
1740；1730
1741
物理化学的性質
- 融点
- -75 °C · <-75°C
- 沸点
- 150 · 150-159 °C/12 mmHg (lit.) 263-265 °C (lit.)
- 比重(密度)
- 0.794 g/mL · 0.794 g/mL at 25 °C (lit.)
- 蒸気密度
- 9.3 · 9.3 (vs air)
- 蒸気圧
- 1 mm · <1 mm Hg ( 20 °C)
- 屈折率
- 20 · n20/D 1.442(lit.)
- 闪点
- 230 °F · >230 °F
- 溶解性
- Chloroform (Slightly), Methanol (Slightly)
- 酸解離定数(Pka)
- 10.46 · 10.46±0.50(Predicted)
- 外見
- Liquid
- 色
- Colorless to Almost colorless
- 水溶解度
- 水とわずかに混和する。
- BRN
- 1755828 · 1755828
- InChI
- 1S/C18H39N/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h4-18H2,1-3H3
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H317 (70.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H319 (99.4%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (26%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H400 (70.1%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (70.1%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]；H411 (29.9%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 154 reports by companies from 9 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.
危険有害性情報
Regulatory Information
1-Hexanamine, N,N-dihexyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Hexanamine, N,N-dihexyl- 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: 25-09-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25871
Hazards SummaryAn irritant; [Alfa Aesar MSDS]
化学と産業
用途と製造
U.S. Production2023: <50,000 lb；2022: <50,000 lb；2021: 50,000 - <250,000 lb；2020: 50,000 - <250,000 lb
General Manufacturing Information1-Hexanamine, N,N-dihexyl-: ACTIVE
応用分野
使用Tri-n-hexylamine is used as an extractant during isolation and purification of succinic acid from an escherichia coli fermentation broth in pharmaceutical industry. It is also used as an internal standard in screening of human hair specimens for designer drugs by ion mobility spectrometry. Further, it is involved in the synthesis of zinc oxide nanorods. In addition to this, it is used in the preparation of infrared luminescence nanohybrid films.
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