4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy- supplier

Name
5-(TERT-BUTOXYCARBONYLAMINO)-2-METHOXYPYRIDINE-4-CARBOXYLIC ACID
EINECS 214-589-6
CAS No. 183741-86-8
Article Data2
CAS DataBase
Density 1.288 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₆N₂O₅
Boiling Point 415 °C at 760 mmHg
Molecular Weight 268.269
Flash Point 204.8 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 5-(tert-Butoxycarbonylamino)-2-methoxypyridine-4-carboxylicacid;
PSA 97.75000
LogP 2.20840

4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy- Specification

The 4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-, with the CAS registry number 183741-86-8, belongs to the product category of Pyridines. This chemical's molecular formula is C₁₂H₁₆N₂O₅ and molecular weight is 268.27. Its systematic name is called 5-[(tert-butoxycarbonyl)amino]-2-methoxypyridine-4-carboxylic acid.

Physical properties of 4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-: (1)ACD/LogP: 2.95; (2)ACD/LogD (pH 5.5): 0.37; (3)ACD/LogD (pH 7.4): -0.19; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.52; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.565; (12)Molar Refractivity: 67.83 cm³; (13)Molar Volume: 208.2 cm³; (14)Surface Tension: 51.6 dyne/cm; (15)Density: 1.288 g/cm³; (16)Flash Point: 204.8 °C; (17)Enthalpy of Vaporization: 70.44 kJ/mol; (18)Boiling Point: 415 °C at 760 mmHg; (19)Vapour Pressure: 1.24E-07 mmHg at 25°C.

Uses of 4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy-: it can be used to produce 5-Amino-2-methoxypyridine-4-carboxylic acid by heating. This reaction will need reagent aq. KOH with reaction time of 18 hours. The yield is about 93%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC(C)(C)C)Nc1cnc(OC)cc1C(=O)O
(2)InChI: InChI=1/C12H16N2O5/c1-12(2,3)19-11(17)14-8-6-13-9(18-4)5-7(8)10(15)16/h5-6H,1-4H3,(H,14,17)(H,15,16)
(3)InChIKey: YSPBACAUWGFVRJ-UHFFFAOYAX

Product Name

5-(TERT-BUTOXYCARBONYLAMINO)-2-METHOXYPYRIDINE-4-CARBOXYLIC ACID

4-Pyridinecarboxylicacid, 5-[[(1,1-dimethylethoxy)carbonyl]amino]-2-methoxy- Specification

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