Name: Name:3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG0030XG
Rating: 90 (10 reviews)

3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde

CAS No.:

306936-65-2

Catalog Number:

AG0030XG

Molecular Formula:

C11H7F3N2O

Molecular Weight:

240.1813

Catalog Number:

AG0030XG

Chemical Name:

3-[4-(Trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde

CAS Number:

306936-65-2

Molecular Formula:

C11H7F3N2O

Molecular Weight:

240.1813

MDL Number:

MFCD02677691

IUPAC Name:

5-[4-(trifluoromethyl)phenyl]-1H-pyrazole-4-carbaldehyde

InChI:

InChI=1S/C11H7F3N2O/c12-11(13,14)9-3-1-7(2-4-9)10-8(6-17)5-15-16-10/h1-6H,(H,15,16)

InChI Key:

PMKPJAJMBQBTKE-UHFFFAOYSA-N

SMILES:

O=Cc1c[nH]nc1c1ccc(cc1)C(F)(F)F

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

240.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

240.185g/mol

Monoisotopic Mass:

240.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2