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89861-39-2 | 1-Naphthalenecarboxylic acid, 2-hydroxy-4-phenyl-, ethyl ester
CAS No: 89861-39-2 Catalog No: AG003XCE MDL No:
Product Description
Catalog Number:
AG003XCE
Chemical Name:
1-Naphthalenecarboxylic acid, 2-hydroxy-4-phenyl-, ethyl ester
CAS Number:
89861-39-2
Molecular Formula:
C19H16O3
Molecular Weight:
292.3285
IUPAC Name:
ethyl 2-hydroxy-4-phenylnaphthalene-1-carboxylate
InChI:
InChI=1S/C19H16O3/c1-2-22-19(21)18-15-11-7-6-10-14(15)16(12-17(18)20)13-8-4-3-5-9-13/h3-12,20H,2H2,1H3
InChI Key:
HWPDFOKMIFMNIL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(O)cc(c2c1cccc2)c1ccccc1
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.334g/mol
Monoisotopic Mass:
292.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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