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24809-91-4

24809-91-4 | D-Valine, N-(aminocarbonyl)-

CAS No: 24809-91-4 Catalog No: AG002PIN MDL No:MFCD21332684

Product Description

Catalog Number:
AG002PIN
Chemical Name:
D-Valine, N-(aminocarbonyl)-
CAS Number:
24809-91-4
Molecular Formula:
C6H12N2O3
Molecular Weight:
160.1711
MDL Number:
MFCD21332684
IUPAC Name:
(2R)-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-/m1/s1
InChI Key:
JDXMIYHOSFNZKO-SCSAIBSYSA-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  

Literature

Title Journal
Synthesis and biological evaluation of acyclic 3-[(2-hydroxyethoxy)methyl] analogues of antiviral furo- and pyrrolo[2,3-d]pyrimidine nucleosides. Journal of medicinal chemistry 20050714

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