Home Carboxys 6-(1,1-difluoroethyl)pyridine-3-carboxylic acid

6-(1,1-difluoroethyl)pyridine-3-carboxylic acid

CAS No.:
1211515-90-0
Catalog Number:
AG01AL3E
Molecular Formula:
C8H7F2NO2
Molecular Weight:
187.1435
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AL3E
Chemical Name:
6-(1,1-difluoroethyl)pyridine-3-carboxylic acid
CAS Number:
1211515-90-0
Molecular Formula:
C8H7F2NO2
Molecular Weight:
187.1435
MDL Number:
MFCD18261112
IUPAC Name:
6-(1,1-difluoroethyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H7F2NO2/c1-8(9,10)6-3-2-5(4-11-6)7(12)13/h2-4H,1H3,(H,12,13)
InChI Key:
MWUXSHOLOAZGOK-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(nc1)C(F)(F)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.044g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.146g/mol
Monoisotopic Mass:
187.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties