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Home > Fluorides > 1152964-31-2
1152964-31-2 | Ethanone, 1-[3-fluoro-4-(1H-pyrazol-1-yl)phenyl]-
CAS No: 1152964-31-2 Catalog No: AG000GK2 MDL No:MFCD11136849
Product Description
Catalog Number:
AG000GK2
Chemical Name:
Ethanone, 1-[3-fluoro-4-(1H-pyrazol-1-yl)phenyl]-
CAS Number:
1152964-31-2
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
MDL Number:
MFCD11136849
IUPAC Name:
1-(3-fluoro-4-pyrazol-1-ylphenyl)ethanone
InChI:
InChI=1S/C11H9FN2O/c1-8(15)9-3-4-11(10(12)7-9)14-6-2-5-13-14/h2-7H,1H3
InChI Key:
GEYFXUVQFYDULL-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1n1cccn1)C(=O)C
Properties
Complexity:
247
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:
1.7
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