N-Methyl dicyclohexylamine

HCID 24210
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
7560-83-0
Standard SMILES
CN(C1CCCCC1)C1CCCCC1
InChIKey
GSCCALZHGUWNJW-UHFFFAOYSA-N
Molecular formula
C13H25N
Average molar mass
195.34 g/mol
Monoisotopic mass
195.1986998

Overview

N-Cyclohexyl-N-methylcyclohexanamine is an amine.

Names & identifiers

Preferred name
N-Methyl dicyclohexylamine
IUPAC
N-cyclohexyl-N-methylcyclohexanamine
English name
N,N-Dicyclohexylmethylamine
Molecular formula
C13H25N
Molecular weight
195.34

Names & synonyms

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
Show more names
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]

Database identifiers

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

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
14

Experimental & physicochemical properties

Chemical ClassesNitrogen Compounds -> Amines, Aliphatic
LogP3.71
Vapor Pressure0.01 [mmHg]
Physical Description · 2 items

Liquid

Clear slightly yellow liquid or white solid; [MSDSonline]

Physicochemical properties

Melting point
193 · 193-194 °C
Boiling point
265 °C · 265 °C(lit.)
Density
0.912 g/mL · 0.912 g/mL at 25 °C(lit.)
vapor pressure
7.52 Pa · 7.52Pa at 25℃
refractive index
20 · n20/D 1.49(lit.)
Flash point
231 °F · 231 °F

Safety & regulation

GHS classification

GHS Classification · 4 items

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.

Hazard information

Regulatory Information · 4 items

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 item

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%)

Toxicology

Adverse EffectsDermatotoxin - Skin burns.
EPA Provisional Peer-Reviewed Toxicity Values · 3 items

n-Methyl dicyclohexylamine

PDF Document

2011

Safety data

F
10-34
PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk
2
tsca
TSCA listed
rtecs
HY4190000
ridadr
UN 2735 8/PG 2

Chemistry & industry

Uses & manufacturing

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 items

Wholesale and Retail Trade

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

Applications · 2 items

UsesN,N-Dicyclohexylmethylamine is used as a reagent in the base preparation of 13C2- and 2H phenethylamines as internal standards for IDMS by Pd-catalyzed double carbonylation of aryl iodides in the presence of amine nucleophiles followed by deoxygenation.

UsesN,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

Preparation methods

PreparationN,N-Dicyclohexylmethylamine is prepared by methylating dicyclohexylamine with dimethyl sulfate or by the Leuckart – Wallach reaction.

Upstream & downstream products

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]

Additional notes

DefinitionChEBI: N-Cyclohexyl-N-methylcyclohexanamine is an amine.

Related reactions

383 records
New reaction record

Compound notes

Loading…