CAS 6850-63-1 2,6-Dimethylcyclohexylamine (HCID 110932)

Substructure search Find similar structures

Basic information

CAS: 6850-63-1
Standard SMILES: CC1CCCC(C)C1N
InChIKey: KSGAAWJLYHYMLT-UHFFFAOYSA-N
Molecular formula: C8H17N
Average molar mass: 127.23 g/mol
Monoisotopic mass: 127.13609954

Names & identifiers

Preferred name: 2,6-Dimethylcyclohexylamine
IUPAC: 2,6-dimethylcyclohexan-1-amine
English name: 2,6-Dimethylcyclohexylamine
Molecular formula: C8H17N
Molecular weight: 127.23

Names & synonyms

2,6-Dimethylcyclohexylamine2,6-dimethylcyclohexanamineEINECS 229-942-2EC 229-942-2RefChem:445719229-942-22,6-dimethylcyclohexan-1-amine6850-63-1MFCD0107516026-Dimethylcyclohexanamine2,6-dimethyl cyclohexylamine2,6-dimethylcyclohexyl amine

Show more names

Glimepiride Impurity 502,6-DimethylcyclohexylaminCyclohexanaMine,2,6-diMethyl-

SCHEMBL7703742, 6-dimethylcyclohexyl amineSCHEMBL5598723SCHEMBL20544142DTXSID60988158AKOS000130767AB93192BS-13032

Database identifiers

CAS: 6850-63-1
PubChem CID: 110932
DTXSID: DTXSID60988158
EC Number: 229-942-2
Nikkaji: J265.930A

Properties

Computed structural properties

XLogP: 2
Topological polar surface area: 26 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 80.6

Physicochemical properties

Boiling point: 160.3 · 160.3±8.0 °C(Predicted)
Density: 0.826 · 0.826±0.06 g/cm3(Predicted)
storage temp.: Store at Room Tem.
pka: 10.88 · 10.88±0.70(Predicted)
Symbol(GHS): 2 · GHS02,GHS05,GHS06
Signal word: Danger
Hazard statements: 331 · H331-H301-H314-H226-H318
Precautionary statements: 261 · P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
REACH Registrations: Active

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H226 (99.1%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 107 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationStatus: Active Update: 11-02-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/1795

Hazard Classes and CategoriesFlam. Liq. 3 (99.1%)

Safety data

Signal word: Danger
Symbol(GHS): GHS02,GHS05,GHS06
Hazard statements: H331-H301-H314-H226-H318
REACH Registrations: Active
Precautionary statements: P261-P271-P304+P340-P311-P321-P403+P233-P405-P501-P264-P270-P301+P310-P321-P330-P405-P501-P280-P305+P351+P338-P310-P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501