1,3-Benzenediol,2-chloro- (6201-65-6)

The IUPAC name of 2-Chlororesorcinol is 2-chlorobenzene-1,3-diol. With the CAS registry number 6201-65-6, it is also named as 2-Chlorobenzene-1,3-diol. The product's category is Intermediates of Dyes and Pigments. Besides, it is white solid, which is used as pharmaceutical and pesticides intermediates. In addition, its molecular formula is C₆H₅ClO₂ and molecular weight is 144.56.

The other characteristics of 2-Chlororesorcinol can be summarized as: (1)EINECS: 228-256-0; (2)ACD/LogP: 1.28; (3)# of Rule of 5 Violations: 0; (4)ACD/LogD (pH 5.5): 1.28; (5)ACD/LogD (pH 7.4): 1.18; (6)ACD/BCF (pH 5.5): 5.5; (7)ACD/BCF (pH 7.4): 4.36; (8)ACD/KOC (pH 5.5): 117.82; (9)ACD/KOC (pH 7.4): 93.37; (10)H bond acceptors: 2; (11)H bond donors: 2; (12)Freely Rotating Bonds: 2; (13)Index of Refraction: 1.629; (14)Molar Refractivity: 34.91 cm³; (15)Molar Volume: 98.2 cm³ ; (16)Surface Tension: 59.7 dyne/cm; (17)Density: 1.471 g/cm³; (18)Flash Point: 101.4 °C; (19)Melting Point: 94-99 °C; (20)Enthalpy of Vaporization: 50.06 kJ/mol; (21)Boiling Point: 244.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0198 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: it is harmful if swallowed. And it is irritating to respiratory system and skin and risk of serious damage to the eyes. You should wear suitable protective clothing, gloves and eye / face protection. It is also harmful to aquatic organisms that may cause long-term adverse effects in the aquatic environment. Please avoid release to the environment. And please refer to special instructions / safety data sheets. Moreover, in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

People can use the following data to convert to the molecule structure.
(1)SMILES:Clc1c(O)cccc1O
(2)InChI:InChI=1/C6H5ClO2/c7-6-4(8)2-1-3-5(6)9/h1-3,8-9H
(3)InChIKey:SWZVJOLLQTWFCW-UHFFFAOYAU
(4)Std. InChI:InChI=1S/C6H5ClO2/c7-6-4(8)2-1-3-5(6)9/h1-3,8-9H
(5)Std. InChIKey:SWZVJOLLQTWFCW-UHFFFAOYSA-N