Home Carboxys 5-(2,2-difluoroethoxy)pyridine-3-carboxylic acid

5-(2,2-difluoroethoxy)pyridine-3-carboxylic acid

CAS No.:
1342512-20-2
Catalog Number:
AG01A1B6
Molecular Formula:
C8H7F2NO3
Molecular Weight:
203.1429
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Product Description
Catalog Number:
AG01A1B6
Chemical Name:
5-(2,2-difluoroethoxy)pyridine-3-carboxylic acid
CAS Number:
1342512-20-2
Molecular Formula:
C8H7F2NO3
Molecular Weight:
203.1429
MDL Number:
MFCD18898219
IUPAC Name:
5-(2,2-difluoroethoxy)pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H7F2NO3/c9-7(10)4-14-6-1-5(8(12)13)2-11-3-6/h1-3,7H,4H2,(H,12,13)
InChI Key:
PNBVXEXBHVLQOZ-UHFFFAOYSA-N
SMILES:
FC(COc1cncc(c1)C(=O)O)F
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.039g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
203.145g/mol
Monoisotopic Mass:
203.039g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties