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ヘキサデシルアミン

Hexadecylamine

HCID 8926
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印刷プレビュー
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
部分構造検索類似構造を探す

基本情報

CAS
143-27-1
標準SMILES
CCCCCCCCCCCCCCCCN
InChIKey
FJLUATLTXUNBOT-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

Hexadecylamine is a white solid. (NTP, 1992)

名称と識別子

優先名称
Hexadecylamine
IUPAC
hexadecan-1-amine
現地名
ヘキサデシルアミン
英語名
1-Hexadecylamine
分子式
C16H35N
分子量
241.46

名称と別名

Hexadecylamine1-HexadecylamineCetylamine143-27-1hexadecan-1-amine1-Hexadecanamine1-AminohexadecaneN-HEXADECYLAMINEPalmitaminen-CetylamineHexyldecylaminePalmitylamine
名称をさらに表示
ヘキサデシルアミンセチルアミンヘキサデカン-1-アミンセチラミン1-アミノヘキサデカンアルミーン16Dアラミン61-ヘキサデカンアミンN-ヘキサデシルアミンヘキサデシルアミン(セチルアミン)N‐ヘキサデシルアミン1-ヘキサデシルアミン, TECH. 90%, REMAINDER MAINLY 1-OCTADECYLAMINE1-ヘキサデシルアミンHDAHADArmeen 16
Armeen 16DMonohexadecylamineAlamine 6Palmityl amineNissan amine PBCetylaminAlamine 6D1-Hexadecanylamine

データベース識別子

CAS
143-27-1、68037-95-6
PubChem CID
8926
DTXSID
DTXSID7025390
ChEMBL
CHEMBL1534653
ChEBI
CHEBI:165594
UNII
O2H0Q02M4P
EC Number
205-596-8
Nikkaji
J6.125E

物性

構造計算による物性

XLogP
7.4
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
14
重原子数
17
形式電荷
0
複雑度
123

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
CosmeticsAntistatic
SpringerMaterials PropertiesBoiling point
Density · 2 件

0.8129 at 68 °F (NTP, 1992) - Less dense than water; will float

0.8129 @ 20°C

Solubilityless than 1 mg/mL at 72 °F (NTP, 1992)
Flash Point285 °F (NTP, 1992)
Boiling Point · 2 件

613 °F at 760 mmHg (NTP, 1992)

322.5 °C @760 [mm Hg]

Melting Point115.2 °F (NTP, 1992)
Physical Description · 2 件

Hexadecylamine is a white solid. (NTP, 1992)

White waxy solid with an ammoniacal odor; [CAMEO] White crystalline solid with a weak odor; [Alfa Aesar MSDS]

物理化学的性質

融点

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 · 6 件

Danger

H314 (98%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P264+P265, P273, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

H302: Harmful if swallowed [Warning Acute toxicity, oral]

危険有害性情報

Regulatory Information · 3 件

Chemical: 1-Hexadecanamine

Status: Active Update: 30-09-2020 https://echa.europa.eu/registration-dossier/-/registered-dossier/29504

Hexadecylamine: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Primary aliphatic (C12-22) and fatty amines: Human health tier II assessment
DOT LabelCorrosive
Fire HazardsThis chemical is combustible. (NTP, 1992)
Health HazardsExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Hazards SummaryMay cause skin, eye, and mucous membrane irritation; [CAMEO] Causes burns; Inhalation may cause corrosive injuries to upper respiratory tract and lungs; [Alfa Aesar MSDS] See Decylamine.
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 件

化学と産業

用途と製造

UsesUsed to make other chemicals; [CAMEO]
Use ClassificationCosmetics -> Antistatic
General Manufacturing Information1-Hexadecanamine: ACTIVE
応用分野 · 3 件

用途乳化剤、浸透湿潤剤、分散剤、浮遊選鉱剤、陽イオン活性剤、防水剤の原料

使用1-Hexadecylamine is used for producing resin, senior detergent, anti-caking agent.

一般的な説明A white waxy solid with an ammonia-like odor. Insoluble in water and less dense than water. Hence floats on water. Contact may irritate skin, eyes and mucous membranes. May be toxic by ingestion, inhalation or skin absorption. Used to make other chemicals.

調製方法

純化方法Crystallise the base from thiophene-free *benzene and dry under vacuum over P2O5. Store away from CO2 [Beilstein 4 IV 818.]

上流・下流製品情報

上流原料

酸化ナトリウムDilute hydrochloric acidHexadecanamide, N-hydroxy-1H-Isoindole-1,3(2H)-dione, 2-hexadecyl-セチルアザイドN-ヘキサデシル-1-ヘキサデカンアミン

関連反応

46 件
反応記録を作成
HRID 26352 の反応式
HRID 26352反応物としてuspto-grants-1979_04
HRID 94648 の反応式
HRID 94648反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 97010 の反応式
HRID 97010反応物としてTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 362766 の反応式
HRID 362766反応物としてuspto-grants-1999_02
HRID 363974 の反応式
HRID 363974反応物としてuspto-grants-1986_08
HRID 371894 の反応式
HRID 371894反応物としてuspto-grants-1978_05
HRID 477430 の反応式
HRID 477430反応物としてuspto-grants-1989_12
HRID 543113 の反応式
HRID 543113反応物としてuspto-grants-1987_04
1 / 6 ページ

化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
その他の操作
ノートを作成反応を作成見積依頼を出す
43 · 43-45 °C (lit.)
沸点
330 °C · 330 °C (lit.)
比重(密度)
0 · 0,813 g/cm3
蒸気圧
1 mm · <1 mm Hg ( 20 °C)
屈折率
1.4496 · 1.4496
闪点
285 °F · 285 °F
貯蔵温度
30 °C · Store below +30°C.
酸解離定数(Pka)
10.63 · 10.63(at 25℃)
外見
低融点結晶塊または塊
色
白い
水溶解度
不溶性
BRN
1634065 · 1634065
化粧品成分の機能
帯電防止
InChI
1S/C16H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-17H2,1H3
InChIKey
FJLUATLTXUNBOT-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCN
LogP
6.73 at · 6.73 at 25℃
CAS データベース
143 · 143-27-1(CAS DataBase Reference)
NISTの化学物質情報
1 · 1-Hexadecanamine(143-27-1)
EPAの化学物質情報
Hexadecylamine (143-27-1)

化学的性質

化学的特性white low melting crystalline mass or chunks

HEXADECYLAMINE may react with oxidizing agents (NTP, 1992). Readily 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.

Air and Water ReactionsThis compound may be sensitive to prolonged exposure to air. Insoluble in water.
Hazard Classes and Categories · 2 件

Skin Corr. 1 (98%)

Acute toxicity - category 4

安全と保護具

Fire FightingFires involving this chemical can be controlled with a CO2, dry chemical, or Halon extinguisher. (NTP, 1992)
First Aid · 1 件

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 · 1 件

SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminate area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.

Isolation and EvacuationExcerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]:
Protective Action Criteria (PAC) · 3 件

0.66 [mg/m3]

7.2 [mg/m3]

43 [mg/m3]

Personal Protective Equipment (PPE)MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves.

毒性情報

Adverse EffectsDermatotoxin - Skin burns.

安全データ

F
34
wgk
2
tsca
TSCA listed
rtecs
ML9100000
ridadr
UN 3259 8/PG 2
毒性
mouse,LD50,intraperitoneal,200mg/kg (200mg/kg),National Technical Information Service. Vol. AD691-490,
hs_code
29211980
risk_code
34
化審法
(2)-133, (2)-176, (2)-185 優先評価化学物質
hazard_code
C,Hazard
safety_code
26-36/37/39-45
hazard_class
8
packing_group
III
Hazard Classifications
Aquatic Acute 1Aquatic Chronic 1Asp. Tox. 1Eye Dam. 1Skin Corr. 1ASTOT RE 2
ストレージクラス
8A - Combustible corrosive hazardous materials
1-クロロヘキサデカン
ヘキサデカンアミド
ヘキサデカンニトリル
7,7,8,8-テトラシアノキノジメタン
ステアリルアミン

下流製品

(3-スルホナトプロピル)ヘキサデシルジメチルアミニウムN-(2-ヒドロキシエチル)-N,N-ジメチル-1-ヘキサデカンアミニウム·クロリドN-ヘキサデシルアクリルアミドヘキサデシルアミン·塩酸塩3-(Hexadecylamino)-1-propanesulfonic acidセトリモニウムクロリド