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Norketamine-d6

CAT: 0572-TRC-N692051-5MGSize: 5 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N692051-5MGSize:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1914951-37-3
Synonyms
2-Amino-2-(2-chlorophenyl)cyclohexanone-d6; (+/-)-Norketamine-d6; 2-(o-Chlorophenyl)-2-aminocyclohexanone-d6; 2-Amino-2-(o-chlorophenyl)cyclohexanone-d6; N-Demethylketamine-d6; 2-Amino-2-(2-chlorophenyl)-cyclohexanone-3,3,4,4,5,5-d6
Hazard Statement
No Data Available
Smiles
[2H]C1([2H])CC(=O)C(N)(c2ccccc2Cl)C([2H])([2H])C1([2H])[2H]
Molecular Formula
C12H8D6ClNO
Molecular Weight
229.74
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Norketamine-d6
CAS Number1914951-37-3
PubChem CID140823423
IUPAC Name2-amino-2-(2-chlorophenyl)-3,3,4,4,5,5-hexadeuteriocyclohexan-1-one
Molecular FormulaC12H14ClNO
Molecular Weight229.73
XLogP1.7
Topological Polar Surface Area43.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity256
SMILES
[2H]C1(CC(=O)C(C(C1([2H])[2H])([2H])[2H])(C2=CC=CC=C2Cl)N)[2H]
InChI
InChI=1S/C12H14ClNO/c13-10-6-2-1-5-9(10)12(14)8-4-3-7-11(12)15/h1-2,5-6H,3-4,7-8,14H2/i3D2,4D2,8D2
InChIKey
BEQZHFIKTBVCAU-MVVLNMNISA-N
Chemical Structure
2D Structure
2D structure of Norketamine-d6
CAS: 1914951-37-3
CID: 140823423
Formula: C12H14ClNO
MW: 229.73
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight229.73
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass229.1140522
Monoisotopic Mass229.1140522
Topological Polar Surface Area43.1 Ų
Heavy Atom Count15
Formal Charge0
Complexity256
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes