Home Other Building Blocks 3-(4-fluorobenzoyl)-1-methyl-1H-pyrazole

3-(4-fluorobenzoyl)-1-methyl-1H-pyrazole

CAS No.:
1432677-91-2
Catalog Number:
AG01A4F7
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
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Product Description
Catalog Number:
AG01A4F7
Chemical Name:
3-(4-fluorobenzoyl)-1-methyl-1H-pyrazole
CAS Number:
1432677-91-2
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
MDL Number:
MFCD21179718
IUPAC Name:
(4-fluorophenyl)-(1-methylpyrazol-3-yl)methanone
InChI:
InChI=1S/C11H9FN2O/c1-14-7-6-10(13-14)11(15)8-2-4-9(12)5-3-8/h2-7H,1H3
InChI Key:
FISDRMZHBSERMF-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)c1ccn(n1)C
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.07g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.204g/mol
Monoisotopic Mass:
204.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties