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L-Valine amide hydrobromide

CAT: 0024-sc-286118Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-286118Size:1 g
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CAS Number
33529-85-0

Chemical Information

H-Val-NH2 hbr
CAS Number33529-85-0
PubChem CID57364729
IUPAC Name(2S)-2-amino-3-methylbutanamide;hydrobromide
Molecular FormulaC5H13BrN2O
Molecular Weight197.07
Topological Polar Surface Area69.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity90
SMILES
CC(C)[C@@H](C(=O)N)N.Br
InChI
InChI=1S/C5H12N2O.BrH/c1-3(2)4(6)5(7)8;/h3-4H,6H2,1-2H3,(H2,7,8);1H/t4-;/m0./s1
InChIKey
XLKXVRIZKXQGGR-WCCKRBBISA-N
Chemical Structure
2D Structure
2D structure of H-Val-NH2 hbr
CAS: 33529-85-0
CID: 57364729
Formula: C5H13BrN2O
MW: 197.07
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight197.07
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass196.02113
Monoisotopic Mass196.02113
Topological Polar Surface Area69.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity90.4
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