N,N-Dimethylcyclohexylamine

HCID 7415CAS 98-94-2

Basic information

Standard SMILES
CN(C)C1CCCCC1
InChIKey
SVYKKECYCPFKGB-UHFFFAOYSA-N
Molecular formula
C8H17N
Average molar mass
127.23 g/mol
Monoisotopic mass
127.13609954

Overview

Dimethylcyclohexylamine is a colorless liquid with a musky ammonia odor. Less dense than water. (USCG, 1999)

Names & identifiers

Preferred name
N,N-Dimethylcyclohexylamine
IUPAC
N,N-dimethylcyclohexanamine
English name
N,N-Dimethylcyclohexylamine
Molecular formula
C8H17N
Molecular weight
127.23

Names & synonyms

N,N-DIMETHYLCYCLOHEXYLAMINE98-94-2N,N-DimethylcyclohexanamineCyclohexyldimethylamineDimethylcyclohexylamineN-CyclohexyldimethylamineCyclohexanamine, N,N-dimethyl-(Dimethylamino)cyclohexaneCyclohexylamine, N,N-dimethyl-N,N-DimethylaminocyclohexaneN,N-Dimethyl-N-cyclohexylamineDTXSID9026633
Show more names
DMCHAPC8Polycat 8N,N-dimethyl-CyclohexanamineCyclohexanamine,N,N-dimethyl-
N1H19E7HTANSC-163904DTXCID906633CHEBI:59022RefChem:161290202-715-5DimethylaminocyclohexaneNSC 163904

Database identifiers

CAS
98-94-2
PubChem CID
7415
DTXSID
DTXSID9026633
ChEMBL
CHEMBL3186662
ChEBI
CHEBI:59022
UNII
N1H19E7HTA
EC Number
202-715-5
Nikkaji
J4.960C

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
9

Experimental & physicochemical properties

Chemical Classes · 2 items

Nitrogen Compounds -> Amines, Aliphatic

Corrosives

SpringerMaterials Properties15N nuclear magnetic resonance spectrum
LogP2.01
Density · 4 items

0.849 at 68 °F (USCG, 1999) - Less dense than water; will float

0.8490 @ 20 °C/20 °C

Relative density (water = 1): 0.85

0.8490 @ 20°C

Color/FormWATER-WHITE LIQ
Solubility · 2 items

PARTLY SOL IN WATER; MISCIBLE WITH ALC, BENZENE, ACETONE

Solubility in water, g/100ml: 20

Physicochemical properties

Melting point
-60 °C · -60 °C
Boiling point
158 · 158-159 °C (lit.)
Density
0.849 g/mL · 0.849 g/mL at 25 °C (lit.)
vapor pressure
3.6 mm · 3.6 mm Hg ( 20 °C)
refractive index
20 · n20/D 1.454(lit.)
Flash point
108 °F · 108 °F

Safety & regulation

GHS classification

GHS Classification · 6 items

This chemical does not meet GHS hazard criteria for 14.6% (68 of 466) of reports.

Danger

H226 (85.2%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P361+P364, P363, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 466 reports by companies from 27 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

Hazard information

Regulatory Information · 5 items

Chemical: Cyclohexanamine, N,N-dimethyl-

Cyclohexanamine, N,N-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Cyclohexanamine, N,N-dimethyl- 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: 28-02-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/13521

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

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelCorrosive Flammable Liquid
Fire Hazards · 4 items

Behavior in Fire: Dangerous when exposed to heat or flame. Can react vigorously with oxidizing materials. (USCG, 1999)

· Flammable/combustible material.

· Flammable/combustible material.

Flammable. Gives off irritating or toxic fumes (or gases) in a fire. Above 42.2 °C explosive vapour/air mixtures may be formed.

Health Hazards · 3 items

Inhalation of high concentration of vapor will will produce irritation of the respiratory tract and lungs. Inhalation of large quantities of vapor may be fatal. (USCG, 1999)

· May cause toxic effects if inhaled or ingested.

· May cause toxic effects if inhaled or ingested.

Hazards Summary · 1 item

A corrosive substance that can cause injury to the skin, eyes, and respiratory tract; Inhalation may cause pulmonary edema; Can be absorbed through skin; [ICSC] Irritating or corrosive to animal skin; Irritating to rabbit eyes; Not sensitizing to guinea pig skin using skin painting test; [IUCLID] Causes muscle contraction or spasticity in lethal-dose studies of mice (inhalation and oral routes); [RTECS] Causes burns; Toxic if inhaled; [Alfa Aesar MSDS]

DOT ID and Guide · 2 items

2264 132

2264 132

Safety & protection

Fire Fighting · 2 items

Fire Extinguishing Agents: Carbon dioxide, dry chemical powder, polymer or alcohol foam. (USCG, 1999)

Use water spray, powder, alcohol-resistant foam, carbon dioxide. In case of fire: keep drums, etc., cool by spraying with water.

First Aid Measures · 4 items

Fresh air, rest. Half-upright position. Artificial respiration may be needed. Refer for medical attention.

First rinse with plenty of water for at least 15 minutes, then remove contaminated clothes and rinse again. Refer for medical attention .

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

Rinse mouth. Give one or two glasses of water to drink. Do NOT induce vomiting. Refer for medical attention .

Accidental Release Measures · 4 items

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 3 items

Get medical attention.

General First Aid:

General First Aid:

Safe StorageFireproof. Separated from strong acids and food and feedstuffs.
Exposure Control and Personal Protection · 2 items

· Wear positive pressure self-contained breathing apparatus (SCBA).

· Wear positive pressure self-contained breathing apparatus (SCBA).

Toxicology

Adverse EffectsDermatotoxin - Skin burns.
Exposure RoutesThe substance can be absorbed into the body by inhalation, through the skin and by ingestion.
Signs and Symptoms · 4 items

Sore throat. Burning sensation. Cough. Laboured breathing. Shortness of breath. Symptoms may be delayed.

Redness. Pain. Skin burns.

Redness. Pain. Severe deep burns.

Burning sensation. Abdominal pain. Shock or collapse.

ICSC Environmental DataThe substance is harmful to aquatic organisms.
Toxicity DataLC50 (rat) = 1,889 mg/m3/2h
EPA Provisional Peer-Reviewed Toxicity Values · 3 items

n,n-Dimethylcyclohexylamine

PDF Document

2011

Safety data

PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk
1
tsca
TSCA listed
rtecs
GX1198000
ridadr
UN 2264
hs_code
29213010

Chemistry & industry

Uses & manufacturing

Uses · 6 items

Used as a catalyst for polyurethane foams and an intermediate for rubber accelerators and dyes; Also used in the treatment of textiles; [HSDB]

Textiles (Fiber & Fabric Manufacturing) [Category: Industry]

CATALYST FOR POLYURETHANE FOAMS; INTERMEDIATE FOR RUBBER ACCELERATORS; TREATMENT OF TEXTILES

CHEMICAL INTERMEDIATE, EG, FOR RUBBER ACCELERATORS & DYES

CATALYST FOR POLYURETHANE FOAMS (POSSIBLE USE)

COMPONENT OF TEXTILE TREATMENTS (POSSIBLE USE)

U.S. Exports · 2 items

(1979) No Data

(1981) No Data

U.S. Imports · 2 items

(1979) 2.33X10+7 GRAMS (PRINCPL CUSTMS DISTS)

(1981) 2.49X10+8 GRAMS (PRINCPL CUSTMS DISTS)

U.S. Production · 3 items

2023: 2,500,000 - <4,000,000 lb

(1979) PROBABLY GREATER THAN 2.27X10+6 GRAMS

(1981) PROBABLY GREATER THAN 2.27X10+6 GRAMS

Consumer UsesCatalyst
Industry UsesChemical reaction regulator
Applications · 3 items

UsesDimethylcyclohexylamine is used in polyurethane plastics and textiles and as a chemical intermediate.

UsesN,N-Dimethylcyclohexylamine has been used:as switchable hydrophilicity solvent (SHS) for the extraction of lipids from freeze-dried samples of Botryococcus braunii microalgae for biofuel productionas catalyst in three-component organocatalyzed Strecker reaction on water

General DescriptionColorless liquid with a musky ammonia odor. Less dense than water.

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [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]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

Additional notes

DefinitionChEBI: A tertiary amine consisting of cyclohexane having a dimethylamino substituent.

Related reactions

47 records

Linked notes

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