Name: Name:ethyl 5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carboxylate
Brand: Angene
SKU: AG01DI8G
Rating: 90 (10 reviews)

ethyl 5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carboxylate

CAS No.:

1361019-08-0

Catalog Number:

AG01DI8G

Molecular Formula:

C13H12F2N2O2

Molecular Weight:

266.2434

Catalog Number:

AG01DI8G

Chemical Name:

ethyl 5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carboxylate

CAS Number:

1361019-08-0

Molecular Formula:

C13H12F2N2O2

Molecular Weight:

266.2434

MDL Number:

MFCD31652686

IUPAC Name:

ethyl 5-(2,6-difluorophenyl)-1-methylpyrazole-3-carboxylate

InChI:

InChI=1S/C13H12F2N2O2/c1-3-19-13(18)10-7-11(17(2)16-10)12-8(14)5-4-6-9(12)15/h4-7H,3H2,1-2H3

InChI Key:

PUWBXNQNPHVRJT-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1nn(c(c1)c1c(F)cccc1F)C

Complexity:

320

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

266.087g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

266.248g/mol

Monoisotopic Mass:

266.087g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6