Home Carboxys 7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

CAS No.:
1694312-73-6
Catalog Number:
AG01BNDC
Molecular Formula:
C8H5F2N3O2
Molecular Weight:
213.1410
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Product Description
Catalog Number:
AG01BNDC
Chemical Name:
7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CAS Number:
1694312-73-6
Molecular Formula:
C8H5F2N3O2
Molecular Weight:
213.1410
MDL Number:
MFCD29503564
IUPAC Name:
7-(difluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
InChI:
InChI=1S/C8H5F2N3O2/c9-7(10)5-1-2-11-6-3-4(8(14)15)12-13(5)6/h1-3,7H,(H,14,15)
InChI Key:
MEPMEQHYWCUMJL-UHFFFAOYSA-N
SMILES:
FC(c1ccnc2n1nc(c2)C(=O)O)F
Properties
Complexity:
264  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.144g/mol
Monoisotopic Mass:
213.035g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties