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(Cyclohexylmethyl) (methyl) amine

CAT: 0127-OR907380Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR907380Size:1 g
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CAS Number
25756-29-0
MDL Number
MFCD01734787
Purity
96%
Smiles
CNCC1CCCCC1

Chemical Information

(Cyclohexylmethyl)(methyl)amine
CAS Number25756-29-0
PubChem CID117276
IUPAC Name1-cyclohexyl-N-methylmethanamine
Molecular FormulaC8H17N
Molecular Weight127.23
XLogP2.2
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity65
SMILES
CNCC1CCCCC1
InChI
InChI=1S/C8H17N/c1-9-7-8-5-3-2-4-6-8/h8-9H,2-7H2,1H3
InChIKey
IWHLPMBLJZJCJK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (Cyclohexylmethyl)(methyl)amine
CAS: 25756-29-0
CID: 117276
Formula: C8H17N
MW: 127.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight127.23
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass127.136099547
Monoisotopic Mass127.136099547
Topological Polar Surface Area12 Ų
Heavy Atom Count9
Formal Charge0
Complexity65
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

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