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| CAS No.: | 7579-20-6 |
|---|---|
| Name: | 3-Aminoisonicotinic acid |
| Article Data: | 35 |
| Molecular Structure: | |
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|
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| Formula: | C6H6N2O2 |
| Molecular Weight: | 138.126 |
| Synonyms: | 3-Amino-4-pyridinecarboxylic acid;3-Aminopyridine-4-carboxylic acid; |
| EINECS: | 676-875-3 |
| Density: | 1.417 g/cm3 |
| Melting Point: | 300 °C |
| Boiling Point: | 497.1 °C at 760 mmHg |
| Flash Point: | 254.4 °C |
| Appearance: | light yellow crystalline |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-37/39 |
| PSA: | 76.21000 |
| LogP: | 0.94320 |
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Specification
The 3-Aminopyridine-4-carboxylic acid, with the CAS register number 7579-20-6, has other names as timtec-bb sbb002130; buttpark 43\57-53; 4-pyridinecarboxylic acid, 3-amino-; 3-amino-4-pyridinecarboxylic acid; 3-aminopyridine-4-carboxylicacid 95+%; 3-amino-4-picolin; 3-aminoisonicotinic acid hydrochloride; 4-pyridinecarboxylicacid,3-amino-(9ci).
The characteristics of this chemical could be summarized as: (1)ACD/LogP: 0.39; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 2; (9)Polar Surface Area: 42.43; (10)Index of Refraction: 1.649; (11)Molar Refractivity: 35.51 cm3; (12)Molar Volume: 97.4 cm3; (13)Polarizability: 14.07 ×10-24 cm3; (14)Surface Tension: 77.7 dyne/cm; (15)Density: 1.417 g/cm3; (16)Flash Point: 254.4 °C; (17)Enthalpy of Vaporization: 80.56 kJ/mol; (18)Boiling Point: 497.1 °C at 760 mmHg; (19)Vapour Pressure: 1.06E-10 mmHg at 25°C.
This is a kind of light yellow crystalline. Being among the irritant chemicals, this chemical is irritating to eyes, respiratory system and skinmay and it may cause inflammation to the skin or other mucous membranes. So while dealing with this chemical, you should be very cautious and then take the following instructions. Wear suitable protective clothing and eye/face protection, and if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
3-Aminopyridine-4-carboxylic acid is used for medicine,chemical industry and acid medicine. As to its product categories, there are various, including aminoacid; amines; blocks; carboxes; pyridines; pyridine series; pyridine; pyridine derivative; amino acids and derivatives; heterocycles; pharmacetical; carboxylic acids; organic acids; chemical amines; carboxylic acids. And its raw materials are covering sodium hydroxide, acetic acid glacial, bromine, acetic anhydride, acetamide, 3,4-pyridinedicarboxylic acid, while its preparation products are the 3-amino-2-chloro-isonicotinamide, 3-amino-2-chloro-isonicotinic acid methyl ester.
Additionally, you could convert the following data information into the molecular structure:
(1)SMILES:c1cncc(c1C(=O)O)NCopyCopied
(2)InChI:InChI=1/C6H6N2O2/c7-5-3-8-2-1-4(5)6(9)10/h1-3H,7H2,(H,9,10) CopyCopied
(3)InChIKey:FYEQKMAVRYRMBL-UHFFFAOYAP
(4)Std. InChI:InChI=1S/C6H6N2O2/c7-5-3-8-2-1-4(5)6(9)10/h1-3H,7H2,(H,9,10)