Name: Name:1-(4-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
Brand: Angene
SKU: AG019VT4
Rating: 90 (10 reviews)

1-(4-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde

CAS No.:

294877-39-7

Catalog Number:

AG019VT4

Molecular Formula:

C12H11BrN2O

Molecular Weight:

279.1325

Catalog Number:

AG019VT4

Chemical Name:

1-(4-bromophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde

CAS Number:

294877-39-7

Molecular Formula:

C12H11BrN2O

Molecular Weight:

279.1325

MDL Number:

MFCD09932059

IUPAC Name:

1-(4-bromophenyl)-3,5-dimethylpyrazole-4-carbaldehyde

InChI:

InChI=1S/C12H11BrN2O/c1-8-12(7-16)9(2)15(14-8)11-5-3-10(13)4-6-11/h3-7H,1-2H3

InChI Key:

NXNTWHLCEXLMEX-UHFFFAOYSA-N

SMILES:

O=Cc1c(C)nn(c1C)c1ccc(cc1)Br

Complexity:

253

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

278.005g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

279.137g/mol

Monoisotopic Mass:

278.005g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

34.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1