N-Methyloctadecylamine (HCID 75539)

名称と識別子

優先名称: N-Methyloctadecylamine
IUPAC: N-methyloctadecan-1-amine
現地名: N-メチル-n-オクタデシルアミン
英語名: N-Methyl-n-octadecylamine
分子式: C19H41N
分子量: 283.54

名称と別名

N-MethyloctadecylamineN-Methyl-N-octadecylamineN-MethylstearylamineMethyloctadecylamineN-Methyl-1-octadecanamine1-Octadecanamine, N-methyl-OctadecylmethylamineMethylstearylamineN-Methyl-N-stearylamineN-Stearyl-N-methylamineN-MethyloctadecanamineOctadecylamine, N-methyl-

名称をさらに表示

N-メチル-n-オクタデシルアミンN-メチルオクタデカン-1-アミンN-メチル-1-オクタデカンアミンN-メチルステアリルアミンN-メチルオクタデシルアミンメチルオクタデシルアミンN‐メチル‐N‐オクタデシルアミンメチル(オクタデシル)アミンAURORA KA-7764STEARYLMETHYLAMINEN-METHYLSTREARYLAMINEn-methyl-octadecylamin

Methyl-n-octadecylamineN-octadecylmethylamineNSC 66468UNII-VII03N5WBXVII03N5WBXEINECS 219-463-7BRN 1758431Methyl-octadecyl-amine

データベース識別子

CAS: 2439-55-6
PubChem CID: 75539
DTXSID: DTXSID50870977
UNII: VII03N5WBX
EC Number: 219-463-7
Nikkaji: J208.739A

物性

構造計算による物性

XLogP: 8.6
極性表面積: 12 Å²
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: 17
重原子数: 20
形式電荷: 0
複雑度: 156

実験および物理化学的性質

Kovats Retention Index2088

物理化学的性質

融点: 42 · 42-46 °C (lit.)
沸点: 346.08 °C · 346.08°C (estimate)
比重(密度): 0.7953 · 0.7953 (estimate)
屈折率: 1.4528 · 1.4528 (estimate)
闪点: 230 °F · >230 °F
溶解性: soluble in Methanol
外見: powder to crystal
酸解離定数(Pka): 10.78 · 10.78±0.10(Predicted)
色: White to Light yellow to Light orange
BRN: 1758431 · 1758431
InChI: 1S/C19H41N/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-2/h20H,3-19H2,1-2H3
InChIKey: SZEGKVHRCLBFKJ-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCCCCNC
CAS データベース: 2439 · 2439-55-6(CAS DataBase Reference)
EPAの化学物質情報: 1 · 1-Octadecanamine, N-methyl- (2439-55-6)

安全と法規制

GHS分類

GHS Classification · 5 件

Danger

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (48.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (51.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]；H411 (48.7%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 78 reports by companies from 4 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 · 2 件

Chemical: 1-Octadecanamine, N-methyl-

Status: Active Update: 22-01-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/16874

Other Safety InformationIMAP assessments - 1-Octadecanamine, N-methyl-: Human health tier I assessment

Hazard Classes and CategoriesSkin Irrit. 2 (100%)；Eye Dam. 1 (48.7%)；Eye Irrit. 2 (51.3%)；STOT SE 3 (50%)；Aquatic Chronic 2 (48.7%)

法規制情報

Regulatory Information · 2 件

Chemical: 1-Octadecanamine, N-methyl-

Status: Active Update: 22-01-2016 https://echa.europa.eu/registration-dossier/-/registered-dossier/16874

安全データ

F: 10-34
wgk: 3
tsca: TSCA listed
rtecs: RG4460000
毒性: mouse,LD50,intraperitoneal,270mg/kg (270mg/kg),European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 26, Pg. 517, 1991.
hs_code: 2921.19.6190
risk_code: 36/37/38
hazard_code: Xi
safety_code: 26-37/39
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3
ストレージクラス: 11 - Combustible Solids