Name: Name:methyl 1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylate
Brand: Angene
SKU: AG01EIS9
Rating: 90 (10 reviews)

methyl 1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylate

CAS No.:

1055071-09-4

Catalog Number:

AG01EIS9

Molecular Formula:

C11H7ClF3N3O2

Molecular Weight:

305.6404

Catalog Number:

AG01EIS9

Chemical Name:

methyl 1-(3-chloropyridin-2-yl)-3-(trifluoromethyl)-1H-pyrazole-5-carboxylate

CAS Number:

1055071-09-4

Molecular Formula:

C11H7ClF3N3O2

Molecular Weight:

305.6404

MDL Number:

MFCD31665238

IUPAC Name:

methyl 2-(3-chloropyridin-2-yl)-5-(trifluoromethyl)pyrazole-3-carboxylate

InChI:

InChI=1S/C11H7ClF3N3O2/c1-20-10(19)7-5-8(11(13,14)15)17-18(7)9-6(12)3-2-4-16-9/h2-5H,1H3

InChI Key:

WZBMWPSSWFZDHG-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(nn1c1ncccc1Cl)C(F)(F)F

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

305.018g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

305.641g/mol

Monoisotopic Mass:

305.018g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9