Dimethyl 2,6-naphthalenedicarboxylate - CAS 840-65-3
Catalog:
BB037125
Product Name:
Dimethyl 2,6-naphthalenedicarboxylate
CAS:
840-65-3
Synonyms:
dimethyl naphthalene-2,6-dicarboxylate
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BB037125
100 g
$298
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IUPAC Name: dimethyl naphthalene-2,6-dicarboxylate
Description: Dimethyl 2,6-naphthalenedicarboxylate (CAS# 840-65-3) is a useful research chemical compound.
Molecular Weight: 244.24
Molecular Formula: C14H12O4
Canonical SMILES: COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)OC
InChI: InChI=1S/C14H12O4/c1-17-13(15)11-5-3-10-8-12(14(16)18-2)6-4-9(10)7-11/h3-8H,1-2H3
InChI Key: GYUVMLBYMPKZAZ-UHFFFAOYSA-N
Boiling Point: 375.3 °C at 760 mmHg
Density: 1.225 g/cm3
Appearance: White crystals or crystalline powder
MDL: MFCD00004100
LogP: 2.41300
Publication Number Title Priority Date
CN-113292409-A Method for separating high-purity 2-methyl-6-acylnaphthalene and 2-methyl-7-acylnaphthalene and application of rectification in method 20210521
CN-112876359-A Preparation method of dimethyl 2, 6-naphthalenedicarboxylate 20210208
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Complexity: 294
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 244.07355886
Formal Charge: 0
Heavy Atom Count: 18
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 0
Isotope Atom Count: 0
Monoisotopic Mass: 244.07355886
Rotatable Bond Count: 4
Topological Polar Surface Area: 52.6
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 2.9
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