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138366-10-6 | 2,3-Naphthalenedicarboxylic acid, 1-hydroxy-7-methoxy-, 2,3-dimethyl ester
CAS No: 138366-10-6 Catalog No: AG0018NG MDL No:
Product Description
Catalog Number:
AG0018NG
Chemical Name:
2,3-Naphthalenedicarboxylic acid, 1-hydroxy-7-methoxy-, 2,3-dimethyl ester
CAS Number:
138366-10-6
Molecular Formula:
C15H14O6
Molecular Weight:
290.2681
IUPAC Name:
dimethyl 1-hydroxy-7-methoxynaphthalene-2,3-dicarboxylate
InChI:
InChI=1S/C15H14O6/c1-19-9-5-4-8-6-11(14(17)20-2)12(15(18)21-3)13(16)10(8)7-9/h4-7,16H,1-3H3
InChI Key:
XKJXFRLRZCAZOZ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)c(O)c(c(c2)C(=O)OC)C(=O)OC
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.079g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.271g/mol
Monoisotopic Mass:
290.079g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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