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4,4-Diethylcyclohexan-1-amine Hydrochloride

CAT: 0572-TRC-D477500-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D477500-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1087747-58-7
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
Cl.CCC1(CC)CCC(N)CC1
Molecular Formula
C10 H21 N . H Cl
Molecular Weight
191.741
InChI
InChI=1S/C10H21N.ClH/c1-3-10(4-2)7-5-9(11)6-8-10;/h9H,3-8,11H2,1-2H3;1H
Additionnal Information
IUPAC name: 4,4-diethylcyclohexanamine;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

4,4-Diethylcyclohexan-1-amine hydrochloride
CAS Number1087747-58-7
PubChem CID75525844
IUPAC Name4,4-diethylcyclohexan-1-amine;hydrochloride
Molecular FormulaC10H22ClN
Molecular Weight191.74
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity106
SMILES
CCC1(CCC(CC1)N)CC.Cl
InChI
InChI=1S/C10H21N.ClH/c1-3-10(4-2)7-5-9(11)6-8-10;/h9H,3-8,11H2,1-2H3;1H
InChIKey
FQAXGDDMVSHAHQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4,4-Diethylcyclohexan-1-amine hydrochloride
CAS: 1087747-58-7
CID: 75525844
Formula: C10H22ClN
MW: 191.74
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight191.74
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass191.1440774
Monoisotopic Mass191.1440774
Topological Polar Surface Area26 Ų
Heavy Atom Count12
Formal Charge0
Complexity106
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

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MTB74758-014,4-Diethylcyclohexan-1-amine hydrochloride
sc-262187A4,4,4-Trifluorobutan-1-amine hydrochloride
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LHB84233-014,4-Difluorobutan-1-amine hydrochloride
APD14407-014,4-Difluorocycloheptan-1-amine hydrochloride
FIC03735-014,4-Difluoropentan-1-amine hydrochloride
OR1065914-014,4-Diphenylbutan-1-amine hydrochloride
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