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Home Other Building Blocks [hydroxy(propan-2-yl)carbamoyl]formic acid

[hydroxy(propan-2-yl)carbamoyl]formic acid

CAS No.:
132418-03-2
Catalog Number:
AG01A436
Molecular Formula:
C5H9NO4
Molecular Weight:
147.1293
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Product Description
Catalog Number:
AG01A436
Chemical Name:
[hydroxy(propan-2-yl)carbamoyl]formic acid
CAS Number:
132418-03-2
Molecular Formula:
C5H9NO4
Molecular Weight:
147.1293
MDL Number:
MFCD19231928
IUPAC Name:
2-[hydroxy(propan-2-yl)amino]-2-oxoacetic acid
InChI:
InChI=1S/C5H9NO4/c1-3(2)6(10)4(7)5(8)9/h3,10H,1-2H3,(H,8,9)
InChI Key:
QVIOSGUKMDGWNN-UHFFFAOYSA-N
SMILES:
CC(N(C(=O)C(=O)O)O)C
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.053g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
147.13g/mol
Monoisotopic Mass:
147.053g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Literature
Title Journal
Conformational changes in a plant ketol-acid reductoisomerase upon Mg(2+) and NADPH binding as revealed by two crystal structures. Journal of molecular biology 20090529
Inhibitors of branched-chain amino acid biosynthesis as potential antituberculosis agents. The Journal of antimicrobial chemotherapy 19981001
Properties