2,6-Dichlorophenol

Details:

1.Introduction of 87-65-0

2,6-Dichlorophenol as the systematic name of this kind of substance, has CAS registry number of 87-65-0. It has synonyms as 2,6-dichlorfenol; 2,6-dichlorfenol(czech); 2,6-dichloro-pheno; 2.6-dichlorohydroxybenzene; dichloro-2,6phenol; phenol,2,6-dichloro-; rcra waste number u082; rcrawastenumberu082. And its product categories are aromatic phenols, phenoles and thiophenoles, alpha sort, d, dalphabetic, dia - dic, pesticides&metabolites, volatiles/ semivolatiles, organic building blocks, oxygen compounds, phenols, building blocks, c6 to c8, chemical synthesis, organic building blocks, oxygen compounds.

2.Properties of 87-65-0

ACD/LogP: 2.896
# of Rule of 5 Violations: 0
ACD/LogD (pH 5.5): 2.88
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 5.5): 90.87
ACD/BCF (pH 7.4): 27.62
ACD/KOC (pH 5.5): 870.52
ACD/KOC (pH 7.4): 264.63
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
Polar Surface Area: 20.23Ų
Index of Refraction: 1.594
Molar Refractivity: 37.925 cm³
Molar Volume: 111.765 cm³
Polarizability: 15.034 10-24cm³
Surface Tension: 47.8979988098145 dyne/cm
Density: 1.458 g/cm³
Flash Point: 94.852 °C
Enthalpy of Vaporization: 47.394 kJ/mol
Boiling Point: 218.999 °C at 760 mmHg
Vapour Pressure: 0.0829999968409538 mmHg at 25°C

3.Structure Descriptors of 87-65-0

(1)InChI: InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
(2)InChIKey: HOLHYSJJBXSLMV-UHFFFAOYSA-N
(3)Canonical SMILES : C1=CC(=C(C(=C1)Cl)O)Cl

4.Safety Information of 87-65-0

Hazard Codes:C,Xi,T,F
Risk Statements:34-36/38-39/23/24/25-23/24/25-11
Safety Statements:26-27-36/37/39-37/39-45-36/37-16
RIDADR:UN 2020 6.1/PG 3
WGK Germany:2
RTECS:SK8750000
Hazard Note:Harmful/Corrosive
HazardClass:6.1
PackingGroup:III
Hazardous Substances Data: 87-65-0(Hazardous Substances Data)