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13962-95-3 | Phenol, 2-[(1-naphthalenylimino)methyl]-
CAS No: 13962-95-3 Catalog No: AG001BEK MDL No:
Product Description
Catalog Number:
AG001BEK
Chemical Name:
Phenol, 2-[(1-naphthalenylimino)methyl]-
CAS Number:
13962-95-3
Molecular Formula:
C17H13NO
Molecular Weight:
247.2912
IUPAC Name:
2-(naphthalen-1-yliminomethyl)phenol
InChI:
InChI=1S/C17H13NO/c19-17-11-4-2-7-14(17)12-18-16-10-5-8-13-6-1-3-9-15(13)16/h1-12,19H
InChI Key:
SOJUPXWRMKYNLZ-UHFFFAOYSA-N
SMILES:
Oc1ccccc1C=Nc1cccc2c1cccc2
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.297g/mol
Monoisotopic Mass:
247.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| Quantitative structure-activity relationship of hydroxyl-substituent Schiff bases in radical-induced hemolysis of human erythrocytes. | Cell biochemistry and function 20080101 |
| Excited state intramolecular proton transfer in Schiff bases. Decay of the locally excited enol state observed by femtosecond resolved fluorescence. | The journal of physical chemistry. A 20070719 |
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