Home Carboxys 3-(difluoromethoxy)pyridine-2-carboxylic acid

3-(difluoromethoxy)pyridine-2-carboxylic acid

CAS No.:
1211541-12-6
Catalog Number:
AG01B5LB
Molecular Formula:
C7H5F2NO3
Molecular Weight:
189.1163
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Product Description
Catalog Number:
AG01B5LB
Chemical Name:
3-(difluoromethoxy)pyridine-2-carboxylic acid
CAS Number:
1211541-12-6
Molecular Formula:
C7H5F2NO3
Molecular Weight:
189.1163
MDL Number:
MFCD14653045
IUPAC Name:
3-(difluoromethoxy)pyridine-2-carboxylic acid
InChI:
InChI=1S/C7H5F2NO3/c8-7(9)13-4-2-1-3-10-5(4)6(11)12/h1-3,7H,(H,11,12)
InChI Key:
XJWOCKIDOISONA-UHFFFAOYSA-N
SMILES:
FC(Oc1cccnc1C(=O)O)F
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.024g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.118g/mol
Monoisotopic Mass:
189.024g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties