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114282-82-5

114282-82-5 | Pentanoic acid, 2-hydroxy-3-oxo-

CAS No: 114282-82-5 Catalog No: AG000AYU MDL No:

Product Description

Catalog Number:
AG000AYU
Chemical Name:
Pentanoic acid, 2-hydroxy-3-oxo-
CAS Number:
114282-82-5
Molecular Formula:
C5H8O4
Molecular Weight:
132.1146
IUPAC Name:
2-hydroxy-3-oxopentanoic acid
InChI:
InChI=1S/C5H8O4/c1-2-3(6)4(7)5(8)9/h4,7H,2H2,1H3,(H,8,9)
InChI Key:
VYWBMMZOBUQRRU-UHFFFAOYSA-N
SMILES:
CCC(=O)C(C(=O)O)O

Properties

Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.042g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.115g/mol
Monoisotopic Mass:
132.042g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  

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