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1- (Aminomethyl) -N-methylcyclohexan-1-amine

CAT: 0926-QDA20299-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-QDA20299-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
90202-99-6
MDL Number
MFCD09959885
Smiles
CNC1 (CCCCC1) CN
Molecular Formula
C8H18N2
Molecular Weight
142.24 g/mol
Controlled
No

Chemical Information

1-(aminomethyl)-N-methylcyclohexan-1-amine
CAS Number90202-99-6
PubChem CID14088188
IUPAC Name1-(aminomethyl)-N-methylcyclohexan-1-amine
Molecular FormulaC8H18N2
Molecular Weight142.24
XLogP0.5
Topological Polar Surface Area38.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity95
SMILES
CNC1(CCCCC1)CN
InChI
InChI=1S/C8H18N2/c1-10-8(7-9)5-3-2-4-6-8/h10H,2-7,9H2,1H3
InChIKey
JAIQRJHHIZIWGR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(aminomethyl)-N-methylcyclohexan-1-amine
CAS: 90202-99-6
CID: 14088188
Formula: C8H18N2
MW: 142.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight142.24
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass142.146998583
Monoisotopic Mass142.146998583
Topological Polar Surface Area38.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity95.4
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes