Home Carboxys 2,3-Pyridinedicarboxylic acid, 2-(1-methylethyl) ester

2,3-Pyridinedicarboxylic acid, 2-(1-methylethyl) ester

CAS No.:
118892-73-2
Catalog Number:
AG0080SV
Molecular Formula:
C10H10NO4-
Molecular Weight:
208.1907
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Product Description
Catalog Number:
AG0080SV
Chemical Name:
2,3-Pyridinedicarboxylic acid, 2-(1-methylethyl) ester
CAS Number:
118892-73-2
Molecular Formula:
C10H10NO4-
Molecular Weight:
208.1907
MDL Number:
MFCD01075650
IUPAC Name:
2-propan-2-yloxycarbonylpyridine-3-carboxylic acid
InChI:
InChI=1S/C10H11NO4/c1-6(2)15-10(14)8-7(9(12)13)4-3-5-11-8/h3-6H,1-2H3,(H,12,13)
InChI Key:
ISSPPDIMZKGLKN-UHFFFAOYSA-N
SMILES:
CC(OC(=O)c1ncccc1C(=O)[O-])C
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties