Home Other Building Blocks 2-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)acetic acid

2-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)acetic acid

CAS No.:
1518990-45-8
Catalog Number:
AG01BTXS
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BTXS
Chemical Name:
2-(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)acetic acid
CAS Number:
1518990-45-8
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD26938129
IUPAC Name:
2-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)acetic acid
InChI:
InChI=1S/C9H11NO3/c1-5-3-6(2)10-9(13)7(5)4-8(11)12/h3H,4H2,1-2H3,(H,10,13)(H,11,12)
InChI Key:
KOHCDWGQNIFECG-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(C)cc([nH]c1=O)C
Properties
Complexity:
326  
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:
2  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties