Home Carboxys 4,5,6-Trimethyl-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid

4,5,6-Trimethyl-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid

CAS No.:
98996-38-4
Catalog Number:
AG005T8Y
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
5g
95%
In Stock USA
United States
$671
- +
Product Description
Catalog Number:
AG005T8Y
Chemical Name:
4,5,6-Trimethyl-2-oxo-1,2-dihydro-3-pyridinecarboxylic acid
CAS Number:
98996-38-4
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD06208453
IUPAC Name:
4,5,6-trimethyl-2-oxo-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C9H11NO3/c1-4-5(2)7(9(12)13)8(11)10-6(4)3/h1-3H3,(H,10,11)(H,12,13)
InChI Key:
COJZFUMHUMQNEF-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(=O)[nH]c(c(c1C)C)C
Properties
Complexity:
350  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties