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Home Aminos Phenol, 4-(2-naphthalenylamino)-

Phenol, 4-(2-naphthalenylamino)-

CAS No.:
93-45-8
Catalog Number:
AG00IHFW
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
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Product Description
Catalog Number:
AG00IHFW
Chemical Name:
Phenol, 4-(2-naphthalenylamino)-
CAS Number:
93-45-8
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
MDL Number:
MFCD00004053
IUPAC Name:
4-(naphthalen-2-ylamino)phenol
InChI:
InChI=1S/C16H13NO/c18-16-9-7-14(8-10-16)17-15-6-5-12-3-1-2-4-13(12)11-15/h1-11,17-18H
InChI Key:
RACMGQBQYYWANW-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Nc1ccc2c(c1)cccc2
EC Number:
202-248-7
UNII:
391R4KT1XJ
Properties
Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.1g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
235.286g/mol
Monoisotopic Mass:
235.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Literature
Title Journal
Dephenylation of the rubber chemical N-phenyl-2-naphthylamine to carcinogenic 2-naphthylamine: a classical problem revisited. Critical reviews in toxicology 20070101
Mechanism study of N-dephenylation mediated through a N-para-hydroxy metabolite. Current drug discovery technologies 20060601
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Prediction of genotoxicity of chemical compounds by statistical learning methods. Chemical research in toxicology 20050601
Properties