N-Methyl dicyclohexylamine (HCID 24210)

Überblick

N-Cyclohexyl-N-methylcyclohexanamine is an amine.

Namen und Bezeichner

Bevorzugter Name: N-Methyl dicyclohexylamine
IUPAC: N-cyclohexyl-N-methylcyclohexanamine
Lokaler Name: N-Cyclohexyl-N-methylcyclohexanamin
Englischer Name: N,N-Dicyclohexylmethylamine
Summenformel: C13H25N
Molmasse: 195.34

Namen und Synonyme

N-Cyclohexyl-N-methylcyclohexanamine7560-83-0N,N-DicyclohexylmethylamineN-MethyldicyclohexylamineCyclohexanamine, N-cyclohexyl-N-methyl-Dicyclohexylamine, N-methyl-methyldicyclohexylamineHSDB 4370N-METHYL DICYCLOHEXYLAMINEN-Cyclohexyl-N-methylcyclohexylamineDTXSID6044727EINECS 231-453-4

Weitere Namen anzeigen

DicyclohexylmethylamineN-cyclohexyl-N-methyl-CyclohexanamineN,N-Dicyclohexyl-N-methylamineTIMTEC-BB SBB008043N,N-Cyclohexylmethylaminen-methyl-dicyclohexylaminN-methylbicyclohexylamine

RI95G6J8FFNSC 166513BRN 2074991NSC-166513DTXCID4024727METHYLDICYCLOHEXYLAMINE, N-4-12-00-00023 (Beilstein Handbook Reference)N-METHYL DICYCLOHEXYLAMINE [HSDB]

Datenbank-Bezeichner

CAS: 7560-83-0
PubChem CID: 24210
DTXSID: DTXSID6044727
ChEMBL: CHEMBL3186353
ChEBI: CHEBI:183431
UNII: RI95G6J8FF
EC Number: 231-453-4
Nikkaji: J87.276H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,7
Polarare Oberfläche (TPSA): 3,2 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 14
Formalladung: 0
Komplexität: 137

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Amines, Aliphatic

LogP3.71

Vapor Pressure0.01 [mmHg]

Physical Description · 2 Einträge

Liquid

Clear slightly yellow liquid or white solid; [MSDSonline]

Physikochemische Eigenschaften

Schmelzpunkt: 193 · 193-194 °C
Siedepunkt: 265 °C · 265 °C(lit.)
Dichte: 0.912 g/mL · 0.912 g/mL at 25 °C(lit.)
Dampfdruck: 7.52 Pa · 7.52Pa at 25℃
Brechungsindex: 20 · n20/D 1.49(lit.)
Flammpunkt: 231 °F · 231 °F
storage temp.: Inert atmosphere,Room Temperature
Löslichkeit: Chloroform (Slightly), Methanol (Slightly)
Aggregatzustand: clear liquid
pka: 11.03 · 11.03±0.20(Predicted)
Farbe: Colorless to Light orange to Yellow
Wasserlöslichkeit: 740 mg/L · 740mg/L at 25℃
BRN: 2074991 · 2074991
InChI: 1S/C13H25N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3
InChIKey: GSCCALZHGUWNJW-UHFFFAOYSA-N
SMILES: CN(C1CCCCC1)C2CCCCC2
LogP: 3.71 at · 3.71 at 25℃
CAS Datenbank: 7560 · 7560-83-0(CAS DataBase Reference)
NIST chemische Informationen: Cyclohexanamine, N-cyclohexyl-N-methyl-(7560-83-0)
EPA chemische Informationen: Cyclohexanamine, N-cyclohexyl-N-methyl- (7560-83-0)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H301 (74.9%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P262, P264, P264+P265, P270, P273, P280, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 179 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Cyclohexanamine, N-cyclohexyl-N-methyl-

Cyclohexanamine, N-cyclohexyl-N-methyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexanamine, N-cyclohexyl-N-methyl- 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: 11-03-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/23809

Cyclohexanamine, N-cyclohexyl-N-methyl-: Does not have an individual approval but may be used under an appropriate group standard

Hazards Summary · 1 Eintrag

Causes somnolence, convulsions, and acute pulmonary edema in lethal-dose feeding studies of rats; [RTECS] A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may result in chemical pneumonitis; [Aldrich MSDS]

Hazard Classes and CategoriesAcute Tox. 3 (74.9%)

Toxikologische Informationen

Adverse EffectsDermatotoxin - Skin burns.

EPA Provisional Peer-Reviewed Toxicity Values · 3 Einträge

n-Methyl dicyclohexylamine

PDF Document

2011

Sicherheitsdaten

F: 10-34
wgk: 2
tsca: TSCA listed
ridadr: UN 2735 8/PG 2
hs_code: 29213000
RTECS-Nr.: HY4190000
risk_code: 22-34
hazard_code: C
safety_code: 26-36/37/39-45
hazard_class: 8
packing_group: III
Speicherklasse: 8A - Combustible corrosive hazardous materials
Giftige Stoffe Daten: 7560-83-0(Hazardous Substances Data)
Hazard Classifications: Acute Tox. 4 OralSkin Corr. 1B

Chemie und Industrie

Verwendung und Herstellung

UsesUsed as a urethane foam catalyst; [Ullmann]

U.S. Production2023: 250,000 - <550,000 lb

Consumer UsesNot Known or Reasonably Ascertainable

Industry UsesChemical reaction regulator

General Manufacturing Information · 2 Einträge

Wholesale and Retail Trade

Cyclohexanamine, N-cyclohexyl-N-methyl-: ACTIVE

Anwendungen

VerwendenN,N-Dicyclohexylmethylamine has been employed as:catalyst during O-phenylation of tertiary alcohol with organobismuth(V) compoundsbase during Pd-catalyzed 5-endo-trig cyclization of 1-(o-bromophenyl)-2-methylprop-2-en-1-ol