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1696781-45-9 | 5-fluoro-2-(1-methyl-1H-pyrazol-3-yl)benzaldehyde
CAS No: 1696781-45-9 Catalog No: AG01DQGG MDL No:MFCD29483417
Product Description
Catalog Number:
AG01DQGG
Chemical Name:
5-fluoro-2-(1-methyl-1H-pyrazol-3-yl)benzaldehyde
CAS Number:
1696781-45-9
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
MDL Number:
MFCD29483417
IUPAC Name:
5-fluoro-2-(1-methylpyrazol-3-yl)benzaldehyde
InChI:
InChI=1S/C11H9FN2O/c1-14-5-4-11(13-14)10-3-2-9(12)6-8(10)7-15/h2-7H,1H3
InChI Key:
XFVDNQAUYYCZRM-UHFFFAOYSA-N
SMILES:
O=Cc1cc(F)ccc1c1ccn(n1)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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