Home Carbonyls L-Valine, N-(aminocarbonyl)-

L-Valine, N-(aminocarbonyl)-

CAS No.:
26081-02-7
Catalog Number:
AG002RLP
Molecular Formula:
C6H12N2O3
Molecular Weight:
160.1711
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Product Description
Catalog Number:
AG002RLP
Chemical Name:
L-Valine, N-(aminocarbonyl)-
CAS Number:
26081-02-7
Molecular Formula:
C6H12N2O3
Molecular Weight:
160.1711
MDL Number:
MFCD09863489
IUPAC Name:
(2S)-2-(carbamoylamino)-3-methylbutanoic acid
InChI:
InChI=1S/C6H12N2O3/c1-3(2)4(5(9)10)8-6(7)11/h3-4H,1-2H3,(H,9,10)(H3,7,8,11)/t4-/m0/s1
InChI Key:
JDXMIYHOSFNZKO-BYPYZUCNSA-N
SMILES:
NC(=O)N[C@H](C(=O)O)C(C)C
Properties
Complexity:
167  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
160.085g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
160.173g/mol
Monoisotopic Mass:
160.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6  
Properties