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147589-45-5 | 2-Naphthalenecarboxylic acid, 4-hydroxy-5,8-dimethoxy-, ethyl ester
CAS No: 147589-45-5 Catalog No: AG001EZS MDL No:
Product Description
Catalog Number:
AG001EZS
Chemical Name:
2-Naphthalenecarboxylic acid, 4-hydroxy-5,8-dimethoxy-, ethyl ester
CAS Number:
147589-45-5
Molecular Formula:
C15H16O5
Molecular Weight:
276.2845
IUPAC Name:
ethyl 4-hydroxy-5,8-dimethoxynaphthalene-2-carboxylate
InChI:
InChI=1S/C15H16O5/c1-4-20-15(17)9-7-10-12(18-2)5-6-13(19-3)14(10)11(16)8-9/h5-8,16H,4H2,1-3H3
InChI Key:
XVQNEMDNKDNWOX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(O)c2c(c1)c(OC)ccc2OC
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.1g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
276.288g/mol
Monoisotopic Mass:
276.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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