Basic Information | Post buying leads | Suppliers |
Name |
6-Chloroisothiazolo[5,4-b]pyridine-3-carboxylic acid |
EINECS | N/A |
CAS No. | 932702-35-7 | Density | 1.731 g/cm3 |
PSA | 91.32000 | LogP | 2.04290 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H3ClN2O2S | Boiling Point | 324.449 °C at 760 mmHg |
Molecular Weight | 214.632 | Flash Point | 150.022 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
MolPort-006-727-923; |
The 6-Chloroisothiazolo[5,4-b]pyridine-3-carboxylic acid, with the CAS registry number 932702-35-7, is also known as MolPort-006-727-923. This chemical's molecular formula is C7H3ClN2O2S and molecular weight is 214.62892. Its IUPAC name is called 6-chloro-[1,2]thiazolo[5,4-b]pyridine-3-carboxylic acid.
Physical properties of 6-Chloroisothiazolo[5,4-b]pyridine-3-carboxylic acid: (1)ACD/LogP: 1.37; (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: 1; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.75; (10)Molar Refractivity: 50.487 cm3; (11)Molar Volume: 123.956 cm3; (12)Surface Tension: 88.839 dyne/cm; (13)Density: 1.731 g/cm3; (14)Flash Point: 150.022 °C; (15)Enthalpy of Vaporization: 59.8 kJ/mol; (16)Boiling Point: 324.449 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=NC2=C1C(=NS2)C(=O)O)Cl
(2)InChI: InChI=1S/C7H3ClN2O2S/c8-4-2-1-3-5(7(11)12)10-13-6(3)9-4/h1-2H,(H,11,12)
(3)InChIKey: UZVDSWLWDIGGKI-UHFFFAOYSA-N