2,6-Pyridinedicarboxylic acid monomethyl ester supplier

Name
2,6-Pyridinedicarboxylic acid monomethyl ester
EINECS -0
CAS No. 7170-36-7
Article Data3
CAS DataBase
Density 1.361 g/cm³
Solubility
Melting Point 144-146 ºC
Formula C₈H₇NO₄
Boiling Point 392.7 ºC at 760 mmHg
Molecular Weight 181.148
Flash Point 191.3 ºC
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 6-[(Methyloxy)carbonyl]-2-pyridinecarboxylic acid;Monomethyl dipicolinate;6-Methoxcarbonylpicolinic acid;6-Carboxy-2-methoxycarbonylpyridine;6-Carbomethoxypyridine-2-carboxylic acid;6-Carbomethoxy-2-picolinic acid;6-(Methoxycarbonyl)pyridine-2-carboxylic acid;2,6-Pyridinedicarboxylic acid, monomethyl ester(8CI,9CI);2,6-Pyridinedicarboxylicacid, methyl ester (6CI,7CI);2,6-Pyridinedicarboxylicacid, 2-methyl ester;
PSA 76.49000
LogP 0.56640

2,6-Pyridinedicarboxylic acid monomethyl ester Specification

The 2,6-Pyridinedicarboxylic acid monomethyl ester, with the CAS registry number 7170-36-7, is also known as 6-(Methoxycarbonyl)-2-pyridinecarboxylic acid. It belongs to the product category of Pyridine. This chemical's molecular formula is C₈H₇NO₄ and molecular weight is 181.15. What's more, both its IUPAC name and systematic name are the same which is called 6-Methoxycarbonylpyridine-2-carboxylic acid. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 2,6-Pyridinedicarboxylic acid monomethyl ester are: (1)ACD/LogP: -0.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.28; (4)ACD/LogD (pH 7.4): -3.43; (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: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 65.49 Å²; (13)Index of Refraction: 1.56; (14)Molar Refractivity: 43.04 cm³; (15)Molar Volume: 133 cm³; (16)Surface Tension: 58.7 dyne/cm; (17)Density: 1.361 g/cm³; (18)Flash Point: 191.3 °C; (19)Enthalpy of Vaporization: 67.76 kJ/mol; (20)Boiling Point: 392.7 °C at 760 mmHg; (21) Vapour Pressure: 7.18E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OC)c1nc(C(=O)O)ccc1
(2) InChI: InChI=1S/C8H7NO4/c1-13-8(12)6-4-2-3-5(9-6)7(10)11/h2-4H,1H3,(H,10,11)
(3) InChIKey: VWIOMFMPIVMLIR-UHFFFAOYSA-N

Product Name

2,6-Pyridinedicarboxylic acid monomethyl ester

2,6-Pyridinedicarboxylic acid monomethyl ester Specification

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