6-Quinoxalinecarboxylicacid, 2,3-dimethyl- supplier

Name
2,3-DIMETHYL-QUINOXALINE-6-CARBOXYLIC ACID
EINECS
CAS No. 17635-26-6
Article Data8
CAS DataBase
Density 1.303 g/cm³
Solubility
Melting Point 230 °C
Formula C₁₁H₁₀N₂O₂
Boiling Point 359.6 °C at 760 mmHg
Molecular Weight 202.213
Flash Point 171.3 °C
Transport Information
Appearance
Safety 26
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 2,3-Dimethylquinoxaline-6-carboxylicacid;NSC 38549;2,3-Dimethyl-6-quinoxalinecarboxylic acid;
PSA 63.08000
LogP 1.94480

6-Quinoxalinecarboxylicacid, 2,3-dimethyl- Specification

The 6-Quinoxalinecarboxylicacid, 2,3-dimethyl-, with the CAS registry number 17635-26-6, is also known as 2,3-Dimethyl-6-quinoxalinecarboxylic acid. This chemical's molecular formula is C₁₁H₁₀N₂O₂ and molecular weight is 202.21. What's more, its systematic name is 2,3-Dimethylquinoxaline-6-carboxylic acid.

Physical properties of 6-Quinoxalinecarboxylicacid, 2,3-dimethyl- are: (1)ACD/LogP: 1.89; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.15; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 4.35; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 52.08 Å²; (12)Index of Refraction: 1.654; (13)Molar Refractivity: 56.85 cm³; (14)Molar Volume: 155 cm³; (15)Polarizability: 22.54×10^-24cm³; (16)Surface Tension: 62.9 dyne/cm; (17)Density: 1.303 g/cm³; (18)Flash Point: 171.3 °C; (19)Enthalpy of Vaporization: 63.85 kJ/mol; (20)Boiling Point: 359.6 °C at 760 mmHg; (21)Vapour Pressure: 8.51E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=NC2=C(C=C(C=C2)C(=O)O)N=C1C
(2)InChI: InChI=1S/C11H10N2O2/c1-6-7(2)13-10-5-8(11(14)15)3-4-9(10)12-6/h3-5H,1-2H3,(H,14,15)
(3)InChIKey: RCACNAWRFYUKLC-UHFFFAOYSA-N

Product Name

2,3-DIMETHYL-QUINOXALINE-6-CARBOXYLIC ACID

6-Quinoxalinecarboxylicacid, 2,3-dimethyl- Specification

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