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Home > Aldehydes > 1269292-05-8
1269292-05-8 | 1H-Pyrazole-5-carboxaldehyde, 1-(3-fluorophenyl)-
CAS No: 1269292-05-8 Catalog No: AG000TIL MDL No:MFCD20275383
Product Description
Catalog Number:
AG000TIL
Chemical Name:
1H-Pyrazole-5-carboxaldehyde, 1-(3-fluorophenyl)-
CAS Number:
1269292-05-8
Molecular Formula:
C10H7FN2O
Molecular Weight:
190.1738
MDL Number:
MFCD20275383
IUPAC Name:
2-(3-fluorophenyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C10H7FN2O/c11-8-2-1-3-9(6-8)13-10(7-14)4-5-12-13/h1-7H
InChI Key:
YCOZXXHHVMAKJC-UHFFFAOYSA-N
SMILES:
O=Cc1ccnn1c1cccc(c1)F
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.177g/mol
Monoisotopic Mass:
190.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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