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Home > Aldehydes > 1152508-36-5
1152508-36-5 | 3-(3-fluorophenyl)-1-methyl-1H-pyrazole-4-carbaldehyde
CAS No: 1152508-36-5 Catalog No: AG01DYFU MDL No:MFCD11180175
Product Description
Catalog Number:
AG01DYFU
Chemical Name:
3-(3-fluorophenyl)-1-methyl-1H-pyrazole-4-carbaldehyde
CAS Number:
1152508-36-5
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
MDL Number:
MFCD11180175
IUPAC Name:
3-(3-fluorophenyl)-1-methylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C11H9FN2O/c1-14-6-9(7-15)11(13-14)8-3-2-4-10(12)5-8/h2-7H,1H3
InChI Key:
FDJKFRKFHXBWTI-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1cccc(c1)F)C
Properties
Complexity:
237
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:
1.5
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