Home Other Building Blocks METHYL 3-(DIFLUOROMETHYL)-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE-6-CARBOXYLATE

METHYL 3-(DIFLUOROMETHYL)-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE-6-CARBOXYLATE

CAS No.:
1549916-08-6
Catalog Number:
AG01EIG8
Molecular Formula:
C9H7F2N3O2
Molecular Weight:
227.1676
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Product Description
Catalog Number:
AG01EIG8
Chemical Name:
METHYL 3-(DIFLUOROMETHYL)-[1,2,4]TRIAZOLO[4,3-A]PYRIDINE-6-CARBOXYLATE
CAS Number:
1549916-08-6
Molecular Formula:
C9H7F2N3O2
Molecular Weight:
227.1676
MDL Number:
MFCD24087743
IUPAC Name:
methyl 3-(difluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
InChI:
InChI=1S/C9H7F2N3O2/c1-16-9(15)5-2-3-6-12-13-8(7(10)11)14(6)4-5/h2-4,7H,1H3
InChI Key:
ZKBVKHMXSCBUSP-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc2n(c1)c(nn2)C(F)F
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.171g/mol
Monoisotopic Mass:
227.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties