Name: Name:4-bromo-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole
Brand: Angene
SKU: AG019U2E
Rating: 90 (10 reviews)

4-bromo-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole

CAS No.:

1006538-98-2

Catalog Number:

AG019U2E

Molecular Formula:

C11H8BrF3N2

Molecular Weight:

305.0938

Catalog Number:

AG019U2E

Chemical Name:

4-bromo-1-{[3-(trifluoromethyl)phenyl]methyl}-1H-pyrazole

CAS Number:

1006538-98-2

Molecular Formula:

C11H8BrF3N2

Molecular Weight:

305.0938

MDL Number:

MFCD02828766

IUPAC Name:

4-bromo-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazole

InChI:

InChI=1S/C11H8BrF3N2/c12-10-5-16-17(7-10)6-8-2-1-3-9(4-8)11(13,14)15/h1-5,7H,6H2

InChI Key:

DWOQMKZOPXCXIW-UHFFFAOYSA-N

SMILES:

Brc1cnn(c1)Cc1cccc(c1)C(F)(F)F

Complexity:

260

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

303.982g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

305.098g/mol

Monoisotopic Mass:

303.982g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

17.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4