6-Hydroxymethyl-pyridine-2-carboxylic acid supplier

Name
6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLIC ACID
EINECS 200-258-5
CAS No. 1197-10-0
Article Data11
CAS DataBase
Density 1.405 g/cm³
Solubility
Melting Point 137 °C
Formula C₇H₇NO₃
Boiling Point 381.235 °C at 760 mmHg
Molecular Weight 153.137
Flash Point 184.364 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Picolinicacid, 6-(hydroxymethyl)- (7CI,8CI);6-(Hydroxymethyl)-2-pyridinecarboxylic acid;
PSA 70.42000
LogP 0.27210

6-Hydroxymethyl-pyridine-2-carboxylic acid Specification

The IUPAC name of this chemical is 6-(hydroxymethyl)pyridine-2-carboxylic acid. With the CAS registry number 1197-10-0, it is also named as 6-(Hydroxymethyl)picolinic acid. The product's categories are Carboxylic Acids; Pyridines. It is an organic compound with the formula C₇H₇NO₃. Ad the molecular weight is 153.14.

The other characteristics of this product can be summarized as: (1)ACD/LogP: -0.26; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.609; (11)Molar Refractivity: 37.725 cm³; (12)Molar Volume: 109.003 cm³; (13)Polarizability: 14.956×10^-24 cm³; (14)Surface Tension: 71.611 dyne/cm; (15)Enthalpy of Vaporization: 66.401 kJ/mol; (16)Vapour Pressure: 0 mmHg at 25°C; (17)Rotatable Bond Count: 2; (18)Exact Mass: 153.042593; (19)MonoIsotopic Mass: 153.042593; (20)Topological Polar Surface Area: 70.4; (21)Heavy Atom Count: 11; (22)Complexity: 149.

People can use the following data to convert to the molecule structure.
1. SMILES:c1cc(nc(c1)C(=O)O)CO
2. InChI:InChI=1/C7H7NO3/c9-4-5-2-1-3-6(8-5)7(10)11/h1-3,9H,4H2,(H,10,11)
3. InChIKey:SWQMSUWYOLDNBU-UHFFFAOYAV
4. Std. InChI:InChI=1S/C7H7NO3/c9-4-5-2-1-3-6(8-5)7(10)11/h1-3,9H,4H2,(H,10,11)
5. Std. InChIKey:SWQMSUWYOLDNBU-UHFFFAOYSA-N

Product Name

6-HYDROXYMETHYL-PYRIDINE-2-CARBOXYLIC ACID

6-Hydroxymethyl-pyridine-2-carboxylic acid Specification

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