Home Carboxys 2-Pyridinecarboxylic acid, 5-(1-methylethoxy)-

2-Pyridinecarboxylic acid, 5-(1-methylethoxy)-

CAS No.:
832714-60-0
Catalog Number:
AG008IPT
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
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Product Description
Catalog Number:
AG008IPT
Chemical Name:
2-Pyridinecarboxylic acid, 5-(1-methylethoxy)-
CAS Number:
832714-60-0
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD20642016
IUPAC Name:
5-propan-2-yloxypyridine-2-carboxylic acid
InChI:
InChI=1S/C9H11NO3/c1-6(2)13-7-3-4-8(9(11)12)10-5-7/h3-6H,1-2H3,(H,11,12)
InChI Key:
UMQXTTPXTATBGI-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(nc1)C(=O)O)C
Properties
Complexity:
182  
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:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties