Name: Name:5-(4-CHLOROPHENOXY)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBALDEHYDE
Brand: Angene
SKU: AG00BYOX
Rating: 90 (10 reviews)

5-(4-CHLOROPHENOXY)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBALDEHYDE

CAS No.:

321848-47-9

Catalog Number:

AG00BYOX

Molecular Formula:

C12H8ClF3N2O2

Molecular Weight:

304.6523

Catalog Number:

AG00BYOX

Chemical Name:

5-(4-CHLOROPHENOXY)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBALDEHYDE

CAS Number:

321848-47-9

Molecular Formula:

C12H8ClF3N2O2

Molecular Weight:

304.6523

MDL Number:

MFCD11100379

IUPAC Name:

5-(4-chlorophenoxy)-1-methyl-3-(trifluoromethyl)pyrazole-4-carbaldehyde

InChI:

InChI=1S/C12H8ClF3N2O2/c1-18-11(20-8-4-2-7(13)3-5-8)9(6-19)10(17-18)12(14,15)16/h2-6H,1H3

InChI Key:

QWQFYYVRBOEOJP-UHFFFAOYSA-N

SMILES:

O=Cc1c(Oc2ccc(cc2)Cl)n(nc1C(F)(F)F)C

Complexity:

348

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

304.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

304.653g/mol

Monoisotopic Mass:

304.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1