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D-Cyclohexylalaninol Hydrochloride

CAT: 0572-TRC-C987335-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-C987335-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
505031-90-3
Hazard Statement
No Data Available
Smiles
Cl.N[C@@H](CO)CC1CCCCC1
Molecular Formula
C9 H19 N O . H Cl
Molecular Weight
193.714
InChI
InChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8;/h8-9,11H,1-7,10H2;1H/t9-;/m1./s1
Additionnal Information
IUPAC name: (2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride
Shipping Conditions
Room Temperature

Chemical Information

(2R)-2-amino-3-cyclohexylpropan-1-ol hydrochloride
CAS Number505031-90-3
PubChem CID56845682
IUPAC Name(2R)-2-amino-3-cyclohexylpropan-1-ol;hydrochloride
Molecular FormulaC9H20ClNO
Molecular Weight193.71
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity99
SMILES
C1CCC(CC1)C[C@H](CO)N.Cl
InChI
InChI=1S/C9H19NO.ClH/c10-9(7-11)6-8-4-2-1-3-5-8;/h8-9,11H,1-7,10H2;1H/t9-;/m1./s1
InChIKey
BMHYDTXNZNVADC-SBSPUUFOSA-N
Chemical Structure
2D Structure
2D structure of (2R)-2-amino-3-cyclohexylpropan-1-ol hydrochloride
CAS: 505031-90-3
CID: 56845682
Formula: C9H20ClNO
MW: 193.71
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight193.71
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass193.1233420
Monoisotopic Mass193.1233420
Topological Polar Surface Area46.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity99.7
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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