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Alpha-Methyl-L-valine

CAT: 0572-TRC-M338540-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-M338540-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
53940-83-3
Hazard Statement
No Data Available
Smiles
CC(C)[C@](C)(N)C(=O)O
Molecular Formula
C6 H13 N O2
Molecular Weight
131.17
InChI
InChI=1S/C6H13NO2/c1-4(2)6(3,7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t6-/m0/s1
Additionnal Information
IUPAC name: (2S)-2-amino-2,3-dimethylbutanoic acid
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

(S)-2-amino-2,3-dimethylbutanoic acid
CAS Number53940-83-3
PubChem CID7408715
IUPAC Name(2S)-2-amino-2,3-dimethylbutanoic acid
Molecular FormulaC6H13NO2
Molecular Weight131.17
XLogP-1.8
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity122
SMILES
CC(C)[C@@](C)(C(=O)O)N
InChI
InChI=1S/C6H13NO2/c1-4(2)6(3,7)5(8)9/h4H,7H2,1-3H3,(H,8,9)/t6-/m0/s1
InChIKey
GPYTYOMSQHBYTK-LURJTMIESA-N
Chemical Structure
2D Structure
2D structure of (S)-2-amino-2,3-dimethylbutanoic acid
CAS: 53940-83-3
CID: 7408715
Formula: C6H13NO2
MW: 131.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.17
XLogP3-1.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass131.094628657
Monoisotopic Mass131.094628657
Topological Polar Surface Area63.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity122
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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