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1687-48-5 | 1,2-Cyclohexanedione, 1-(2-phenylhydrazone)
CAS No: 1687-48-5 Catalog No: AG001Y8E MDL No:
Product Description
Catalog Number:
AG001Y8E
Chemical Name:
1,2-Cyclohexanedione, 1-(2-phenylhydrazone)
CAS Number:
1687-48-5
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
IUPAC Name:
2-(phenylhydrazinylidene)cyclohexan-1-one
InChI:
InChI=1S/C12H14N2O/c15-12-9-5-4-8-11(12)14-13-10-6-2-1-3-7-10/h1-3,6-7,13H,4-5,8-9H2
InChI Key:
JKGRWIYJFZVNFM-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1=NNc1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.1
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