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Home > Aldehydes > 121187-15-3
121187-15-3 | 3-Pyridinecarboxaldehyde, 4-(4-fluorophenyl)-, hydrochloride
CAS No: 121187-15-3 Catalog No: AG0073Z4 MDL No:
Product Description
Catalog Number:
AG0073Z4
Chemical Name:
3-Pyridinecarboxaldehyde, 4-(4-fluorophenyl)-, hydrochloride
CAS Number:
121187-15-3
Molecular Formula:
C12H9ClFNO
Molecular Weight:
237.6574
IUPAC Name:
4-(4-fluorophenyl)pyridine-3-carbaldehyde;hydrochloride
InChI:
InChI=1S/C12H8FNO.ClH/c13-11-3-1-9(2-4-11)12-5-6-14-7-10(12)8-15;/h1-8H;1H
InChI Key:
LEOJTWTVVAUEEA-UHFFFAOYSA-N
SMILES:
O=Cc1cnccc1c1ccc(cc1)F.Cl
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.036g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.658g/mol
Monoisotopic Mass:
237.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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