Naphthalene-1,4-dicarboxylic acid monomethyl ester

Base Information

• Chemical Name: Naphthalene-1,4-dicarboxylic acid monomethyl ester
• CAS No.: 21426-90-4
• Molecular Formula: C₁₃H₁₀O₄
• Molecular Weight: 230.22
• European Community (EC) Number: 959-934-0
• Nikkaji Number: J1.744.465D
• Mol file: 21426-90-4.mol

Synonyms:4-(methoxycarbonyl)-1-naphthoic acid;21426-90-4;Naphthalene-1,4-dicarboxylic acid monomethyl ester;SCHEMBL5750893;GIDDWUIWEVRLPQ-UHFFFAOYSA-N;4-methoxycarbonylnaphthalene-1-carboxylic acid;METHYL 1,4-NAPHTHALENE MONOCARBOXYLATE;F70337;4-(methoxycarbonyl)naphthalene-1-carboxylic acid;EN300-1672015

Chemical Property of Naphthalene-1,4-dicarboxylic acid monomethyl ester

Chemical Property:

• Melting Point: 148 - 150 °C (hexane)
• Boiling Point: 434.4±28.0 °C(Predicted)
• PSA: 63.60000
• Density: 1.323±0.06 g/cm3(Predicted)
• LogP: 2.32460
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 230.05790880
• Heavy Atom Count: 17
• Complexity: 313

Purity/Quality:

98%+ ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(C2=CC=CC=C21)C(=O)O

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