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102222-52-6 | Benzoic acid, 4-[(diphenylmethylene)amino]-, ethyl ester
CAS No: 102222-52-6 Catalog No: AG0006YT MDL No:
Product Description
Catalog Number:
AG0006YT
Chemical Name:
Benzoic acid, 4-[(diphenylmethylene)amino]-, ethyl ester
CAS Number:
102222-52-6
Molecular Formula:
C22H19NO2
Molecular Weight:
329.3918
IUPAC Name:
ethyl 4-(benzhydrylideneamino)benzoate
InChI:
InChI=1S/C22H19NO2/c1-2-25-22(24)19-13-15-20(16-14-19)23-21(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-16H,2H2,1H3
InChI Key:
ZOSYUBNGVSGZJV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc(cc1)N=C(c1ccccc1)c1ccccc1
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.142g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.399g/mol
Monoisotopic Mass:
329.142g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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