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1-[ (2-Fluorophenyl) methyl]cyclohexan-1-amine hydrochloride

CAT: 0926-FSD25371-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-FSD25371-01Size:50 mg
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CAS Number
2305253-71-6
MDL Number
MFCD31811152
Smiles
C1CCC (CC1) (CC2=CC=CC=C2F) N.Cl
Molecular Formula
C13H19ClFN
Molecular Weight
243.7 g/mol
Controlled
No

Chemical Information

1-[(2-Fluorophenyl)methyl]cyclohexan-1-amine hydrochloride
CAS Number2305253-71-6
PubChem CID138987917
IUPAC Name1-[(2-fluorophenyl)methyl]cyclohexan-1-amine;hydrochloride
Molecular FormulaC13H19ClFN
Molecular Weight243.75
Topological Polar Surface Area26
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity199
SMILES
C1CCC(CC1)(CC2=CC=CC=C2F)N.Cl
InChI
InChI=1S/C13H18FN.ClH/c14-12-7-3-2-6-11(12)10-13(15)8-4-1-5-9-13;/h2-3,6-7H,1,4-5,8-10,15H2;1H
InChIKey
IKYKGEHLKXFZAE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[(2-Fluorophenyl)methyl]cyclohexan-1-amine hydrochloride
CAS: 2305253-71-6
CID: 138987917
Formula: C13H19ClFN
MW: 243.75
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight243.75
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass243.1190055
Monoisotopic Mass243.1190055
Topological Polar Surface Area26 Ų
Heavy Atom Count16
Formal Charge0
Complexity199
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

CatalogName
PC4031364,4-Difluoro-1-[ (2-fluorophenyl) methyl]cyclohexan-1-amine hydrochloride
PC4031544,4-Difluoro-1-[ (4-fluorophenyl) methyl]cyclohexan-1-amine hydrochloride
PC4031374,4-Difluoro-1-[ (3-fluorophenyl) methyl]cyclohexan-1-amine hydrochloride
sc-342739[ (2-fluorophenyl) methyl] (methyl) amine hydrochloride
TRC-F422761-100MG2-(3-Fluorophenyl)-2-((methyl-d3)amino)cyclohexan-1-one hydrochloride
PC49823Rac- (1R,3S) -3- (3-Fluorophenyl) cyclohexan-1-amine hydrochloride
PC51382Rac- (1R,3S) -3- (4-Fluorophenyl) cyclohexan-1-amine hydrochloride
TRC-T023930-100MG2-(2,2,2-trifluoroethoxy)cyclohexan-1-amine hydrochloride
TRC-E356870-50MG2-(Ethylamino)-2-(4-fluorophenyl)cyclohexan-1-one Hydrochloride
HY-W728631-012- (3-Fluorophenyl) -2- (methylamino) cyclohexan-1-one hydrochloride

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