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102536-01-6 | Benzoic acid, 3-(2-phenylhydrazinyl)-, ethyl ester
CAS No: 102536-01-6 Catalog No: AG0007O9 MDL No:
Product Description
Catalog Number:
AG0007O9
Chemical Name:
Benzoic acid, 3-(2-phenylhydrazinyl)-, ethyl ester
CAS Number:
102536-01-6
Molecular Formula:
C15H16N2O2
Molecular Weight:
256.2997
IUPAC Name:
ethyl 3-(2-phenylhydrazinyl)benzoate
InChI:
InChI=1S/C15H16N2O2/c1-2-19-15(18)12-7-6-10-14(11-12)17-16-13-8-4-3-5-9-13/h3-11,16-17H,2H2,1H3
InChI Key:
RAFXVKIDGAVMRN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cccc(c1)NNc1ccccc1
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.121g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.305g/mol
Monoisotopic Mass:
256.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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