Benzoicacid, 2-chloro-6-hydroxy- supplier

Name
6-Chlorosalicylic Acid
EINECS
CAS No. 56961-31-0
Article Data7
CAS DataBase
Density 1.536 g/cm³
Solubility
Melting Point 171.5-172.5 °C
Formula C₇H₅ClO₃
Boiling Point 309.4 °C at 760 mmHg
Molecular Weight 172.568
Flash Point 140.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Chloro-2-hydroxybenzoic acid;6-Chlorosalicylic acid;
PSA 57.53000
LogP 1.74380

Benzoicacid, 2-chloro-6-hydroxy- Specification

The Benzoicacid, 2-chloro-6-hydroxy-, with the CAS registry number 56961-31-0, is also known as 6-Chlorosalicylic acid. It belongs to the product category of API intermediates. This chemical's molecular formula is C₇H₅ClO₃ and molecular weight is 172.57. What's more, its systematic name is 2-chloro-6-hydroxybenzoic acid.

Physical properties of Benzoicacid, 2-chloro-6-hydroxy- are: (1)ACD/LogP: 2.53; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.58; (4)ACD/LogD (pH 7.4): -0.62; (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: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.629; (14)Molar Refractivity: 39.95 cm³; (15)Molar Volume: 112.3 cm³; (16)Polarizability: 15.84×10^-24cm³; (17)Surface Tension: 66 dyne/cm; (18)Density: 1.536 g/cm³; (19)Flash Point: 140.9 °C; (20)Enthalpy of Vaporization: 58.09 kJ/mol; (21)Boiling Point: 309.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000277 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1c(O)cccc1Cl
(2)Std. InChI: InChI=1S/C7H5ClO3/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,9H,(H,10,11)
(3)Std. InChIKey: QCEPIUWMXRQPIF-UHFFFAOYSA-N

Product Name

6-Chlorosalicylic Acid

Benzoicacid, 2-chloro-6-hydroxy- Specification

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