Benzimidazole-5,6-dicarboxylic acid supplier

Name
Benzimidazole-5,6-dicarboxylic acid
EINECS -0
CAS No. 10351-75-4
Article Data5
CAS DataBase
Density 1.716 g/cm³
Solubility Insoluble in water.
Melting Point >310 °C
Formula C₉H₆N₂O₄
Boiling Point 660.334 °C at 760 mmHg
Molecular Weight 206.158
Flash Point 353.157 °C
Transport Information
Appearance
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols R36/37/38:Irritating to eyes, respiratory system and skin.;
Synonyms 5,6-Benzimidazoledicarboxylicacid (8CI);1H-Benzimidazole-5,6-dicarboxylicacid;
PSA 103.28000
LogP 0.95930

Benzimidazole-5,6-dicarboxylic acid Specification

The Benzimidazole-5,6-dicarboxylic acid with the CAS number 10351-75-4 is also called 5,6-Benzimidazoledicarboxylicacid (8CI). The systematic name is 1H-benzimidazole-5,6-dicarboxylic acid. Its molecular formula is C₉H₆N₂O₄. The product category is Pharmaceutical Intermediates.

The properties of the Benzimidazole-5,6-dicarboxylic acid are: (1)ACD/LogP: -0.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.4; (4)ACD/LogD (pH 7.4): -4.07; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 70.42Å²; (13)Index of Refraction: 1.781; (14)Molar Refractivity: 50.47 cm³; (15)Molar Volume: 120.1 cm³; (16)Polarizability: 20.01×10^-24cm³; (17)Surface Tension: 109.9 dyne/cm; (18)Enthalpy of Vaporization: 102.1 kJ/mol; (19)Vapour Pressure: 2.45×10^-18mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc2ncnc2cc1C(=O)O
(2)InChI: InChI=1/C9H6N2O4/c12-8(13)4-1-6-7(11-3-10-6)2-5(4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)
(3)InChIKey: PIPQOFRJDBZPFR-UHFFFAOYAQ

Product Name

Benzimidazole-5,6-dicarboxylic acid

Benzimidazole-5,6-dicarboxylic acid Specification

Related Products

Hot Products