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N-Me-Val-OH.HCl

CAT: 0607-A6647-100000Size: 100 gDry Ice: NoHazardous: No
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CAT#:0607-A6647-100000Size:100 g
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CAS Number
2480-23-1
Product Name Alternative
3-methyl-2-(methylamino)butanoic acid
Purity
0.98
Smiles
CC(C)C(C(=O)O)NC
Molecular Formula
C6H13NO2
Molecular Weight
131.17
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

N-Methyl-L-valine

N-methyl-L-valine is an optically active form of N-methylvaline having L-configuration. It is a N-methyl-L-alpha-amino acid and a N-methylvaline.

CAS Number2480-23-1
PubChem CID444080
IUPAC Name(2S)-3-methyl-2-(methylamino)butanoic acid
Molecular FormulaC6H13NO2
Molecular Weight131.17
XLogP-1.5
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count9
Formal Charge0
Complexity101
SMILES
CC(C)[C@@H](C(=O)O)NC
InChI
InChI=1S/C6H13NO2/c1-4(2)5(7-3)6(8)9/h4-5,7H,1-3H3,(H,8,9)/t5-/m0/s1
InChIKey
AKCRVYNORCOYQT-YFKPBYRVSA-N
Chemical Structure
2D Structure
2D structure of N-Methyl-L-valine
CAS: 2480-23-1
CID: 444080
Formula: C6H13NO2
MW: 131.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight131.17
XLogP3-1.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass131.094628657
Monoisotopic Mass131.094628657
Topological Polar Surface Area49.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity101
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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CatalogName
5-05502H-N-Me-Val-OH·HCl
CSB-DT2818Α-Me-D-Val-OH.HCl
OR1051955-01H-N-Me-D-Val-OH.HCl
E-2195.0005N-Me-Val-OH
MBS9023310-01alpha-Me-D-Val-OH.HCl
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4001829.0005Boc-N-Me-Val-OH
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C-3700.0005Z-N-Me-Val-OH
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