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2-Ethylcyclohexan-1-amine

HCID 544854
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
6850-36-8
Standard SMILES
CCC1CCCCC1N
InChIKey
QOPVVDFTPKWSFL-UHFFFAOYSA-N
Molecular formula
C8H17N
Average molar mass
127.23 g/mol

Names & identifiers

Preferred name
2-Ethylcyclohexan-1-amine
IUPAC
2-ethylcyclohexan-1-amine
English name
Cyclohexanamine, 2-ethyl-
Molecular formula
C8H17N
Molecular weight
127.22728

Names & synonyms

2-ethylcyclohexan-1-amine6850-36-8RefChem:471919828-567-72-Ethyl-cyclohexylamine2-Ethylcyclohexanamine2-ethylcyclohexylamine2-Ethylcyclohexanamine #SCHEMBL8949142-ethylcyclohexan-1-amine, Mixture of diastereomersSCHEMBL27608872MFCD09035914
Show more names
Cyclohexanamine, 2-ethyl-
AKOS004117954AKOS022474393SY175061CS-0247815EN300-37405G58133Z368844574

Database identifiers

CAS
6850-36-8
PubChem CID
544854
EC Number
828-567-7

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
9
Formal charge
0
Complexity
80.6

Physicochemical properties

Melting point
-15 °C · -15°C (estimate)
Boiling point
166.06 °C · 166.06°C (estimate)
Density
0.8744 · 0.8744
refractive index
1.4682 · 1.4682
Symbol(GHS)
7 · GHS07,GHS02,GHS05
Signal word
Danger
Hazard statements
226 · H226-H314-H335
Precautionary statements
260 · P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P319, P321, P363, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

Signal word
Danger
Symbol(GHS)
GHS07,GHS02,GHS05
Hazard statements
H226-H314-H335
Precautionary statements
P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501

Chemistry & industry

Suppliers3 total

海济医药科技(苏州)有限公司18012778619 · [email protected]
扬州瑞宏生物科技有限公司15380367604; 15380367604 · [email protected]
江苏药泽医药科技有限公司18550739526 · [email protected]

Related reactions

8 records
New reaction record
HRID 123767 reaction equation
HRID 123767As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 155273 reaction equation
HRID 155273As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 700509 reaction equation
HRID 700509As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 890365 reaction equation
HRID 890365As productuspto-grants-2006_02
HRID 890366 reaction equation
HRID 890366As reactantuspto-grants-2006_02
HRID 988966 reaction equation
HRID 988966As productuspto-grants-2003_10
HRID 1750248 reaction equation
HRID 1750248As reactantuspto-grants-2015_10
HRID 2296506 reaction equation
HRID 2296506As reactantuspto-grants-1984_01

Compound notes

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