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1866869-50-2 | 2-fluoro-3-(1-methyl-1H-pyrazol-3-yl)benzaldehyde
CAS No: 1866869-50-2 Catalog No: AG01DQGT MDL No:MFCD31458174
Product Description
Catalog Number:
AG01DQGT
Chemical Name:
2-fluoro-3-(1-methyl-1H-pyrazol-3-yl)benzaldehyde
CAS Number:
1866869-50-2
Molecular Formula:
C11H9FN2O
Molecular Weight:
204.2004
MDL Number:
MFCD31458174
IUPAC Name:
2-fluoro-3-(1-methylpyrazol-3-yl)benzaldehyde
InChI:
InChI=1S/C11H9FN2O/c1-14-6-5-10(13-14)9-4-2-3-8(7-15)11(9)12/h2-7H,1H3
InChI Key:
KOPOSRCPINBJOJ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1F)c1ccn(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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