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Home > Aldehydes > 1266114-21-9
1266114-21-9 | 1H-Pyrazole-5-carboxaldehyde, 1-(4-chlorophenyl)-
CAS No: 1266114-21-9 Catalog No: AG01F987 MDL No:
Product Description
Catalog Number:
AG01F987
Chemical Name:
1H-Pyrazole-5-carboxaldehyde, 1-(4-chlorophenyl)-
CAS Number:
1266114-21-9
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
IUPAC Name:
2-(4-chlorophenyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C10H7ClN2O/c11-8-1-3-9(4-2-8)13-10(7-14)5-6-12-13/h1-7H
InChI Key:
HEUBVIIYJHNKPT-UHFFFAOYSA-N
SMILES:
O=Cc1ccnn1c1ccc(cc1)Cl
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.629g/mol
Monoisotopic Mass:
206.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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