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Cyclohexanemethanol, 4-amino-, cis-

CAT: 0926-FBA13498-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-FBA13498-02Size:0.5 g
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CAS Number
30134-98-6
MDL Number
MFCD16661168
Smiles
C1CC (CCC1CO) N
Molecular Formula
C7H15NO
Molecular Weight
129.2 g/mol
Controlled
No

Chemical Information

((1s,4s)-4-Aminocyclohexyl)methanol
CAS Number30134-98-6
PubChem CID424390
IUPAC Name(4-aminocyclohexyl)methanol
Molecular FormulaC7H15NO
Molecular Weight129.20
XLogP0.1
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity77
SMILES
C1CC(CCC1CO)N
InChI
InChI=1S/C7H15NO/c8-7-3-1-6(5-9)2-4-7/h6-7,9H,1-5,8H2
InChIKey
GHUJZOFJZVGTSN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of ((1s,4s)-4-Aminocyclohexyl)methanol
CAS: 30134-98-6
CID: 424390
Formula: C7H15NO
MW: 129.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight129.20
XLogP30.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass129.115364102
Monoisotopic Mass129.115364102
Topological Polar Surface Area46.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity77
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