2,7-Naphthalenedicarboxylic acid supplier

Name
2,7-Naphthalenedicarboxylic acid
EINECS 817-452-7
CAS No. 2089-89-6
Article Data10
CAS DataBase
Density 1.455g/cm³
Solubility
Melting Point >190 °C (sublm)
Formula C₁₂H₈O₄
Boiling Point 437.281 °C at 760 mmHg
Molecular Weight 216.193
Flash Point 232.396 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,7-NAPHTHALENEDICARBOXYLIC ACID;NAPHTHALENE-2,7-DICARBOXYLICACID;2,7-Naphthalenedicarbxylic acid
PSA 74.60000
LogP 2.23620

2,7-Naphthalenedicarboxylic acid Specification

The 2,7-Naphthalenedicarboxylicacid, with CAS registry number 2089-89-6, has the systematic name of naphthalene-2,7-dicarboxylic acid. And its IUPAC name is the same one. Besides this, the chemical formula of this chemical is C₁₂H₈O₄.

Physical properties of 2,7-Naphthalenedicarboxylicacid: (1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 74.6 Å²; (11)Index of Refraction: 1.708; (12)Molar Refractivity: 57.955 cm³; (13)Molar Volume: 148.608 cm³; (14)Polarizability: 22.975×10^-24cm³; (15)Surface Tension: 73.659 dyne/cm; (16)Enthalpy of Vaporization: 73.135 kJ/mol; (17)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(cc2c1ccc(c2)C(=O)O)C(=O)O
(2)InChI: InChI=1/C12H8O4/c13-11(14)8-3-1-7-2-4-9(12(15)16)6-10(7)5-8/h1-6H,(H,13,14)(H,15,16)
(3)InChIKey: WPUMVKJOWWJPRK-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C12H8O4/c13-11(14)8-3-1-7-2-4-9(12(15)16)6-10(7)5-8/h1-6H,(H,13,14)(H,15,16)
(5)Std. InChIKey: WPUMVKJOWWJPRK-UHFFFAOYSA-N

Product Name

2,7-Naphthalenedicarboxylic acid

2,7-Naphthalenedicarboxylic acid Specification

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