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5768-27-4 | 4-OXO-4-(2-PYRIDYL)BUTYRIC ACID
CAS No: 5768-27-4 Catalog No: AG00ED9S MDL No:MFCD01320175
Product Description
Catalog Number:
AG00ED9S
Chemical Name:
4-OXO-4-(2-PYRIDYL)BUTYRIC ACID
CAS Number:
5768-27-4
MDL Number:
MFCD01320175
IUPAC Name:
4-oxo-4-pyridin-2-ylbutanoic acid
InChI:
InChI=1S/C9H9NO3/c11-8(4-5-9(12)13)7-3-1-2-6-10-7/h1-3,6H,4-5H2,(H,12,13)
InChI Key:
CVKJOHUNVFCNJV-UHFFFAOYSA-N
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
67.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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