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95-57-8

95-57-8 structural image
Product Name: 2-Chlorophenol
Formula: C6H5ClO
Synonyms: 2-Chloro-1-hydroxybenzene;2-Chlorophenol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 2-chlorophenol appears as a colorless to amber liquid with an unpleasant, penetrating odor. Density 1.265 g / cm3. Sinks in water and slowly dissolves. Freezing point 7 °C (46 °F). Boiling point 175 °C (347 °F).
Color/Form Light amber liquid
Odor Unpleasant penetrating odor
Taste Strong medicinal taste and odor
Boiling Point 347 to 349 °F at 760 mmHg (NTP, 1992)
Melting Point 48.2 °F (NTP, 1992)
Flash Point 147 °F (NTP, 1992)
Solubility 10 to 50 mg/mL at 59 °F (NTP, 1992)
Density 1.25 at 77 °F (USCG, 1999) - Denser than water; will sink
Vapor Density Relative vapor density (air = 1): 4.4
Vapor Pressure 1 mmHg at 53.8 °F ; 2.2 mmHg at 68 °F (NTP, 1992)
LogP log Kow = 2.15
Henry's Law Constant Henry's Law constant = 1.12X10-5 atm-cu m/mole at 25 °C
Decomposition When heated to decomposition it emits toxic fumes of /hydrogen chloride/.
Viscosity 3.579 cP at 25 °C
Heat of Combustion 2790.0 kJ.mol at 77 °F (liquid) /25 °C/
Heat of Vaporization 40.12 kJ/mole at 174.53 °C / 447.53 K/
pH weakly acidic
Surface Tension 40.50 dynes/cm at 25 °C
Odor Threshold Odor Threshold Low: 0.0036 [mmHg] [ICSC] Odor threshold (threshold concentration) from CHEMINFO
Refractive Index Index of refraction: 1.5524 @ 20 °C
Dissociation Constants Ka = 3.2X10-9 at 25 °C
Kovats Retention Index 960.5 967.3 973 975 975 979 987 991 1000 1000 987 991 993 987 992 985.9 947 948 952 992 973.3 965
Other Experimental Properties /Threshold for taste is/ 0.1 ug/l.
Chemical Classes Other Classes -> Chlorophenols

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H314:Skin corrosion/irritation
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 128.55 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 128.0028925 g/mol
Monoisotopic Mass 128.0028925 g/mol
Topological Polar Surface Area 20.2 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 74.9
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

2-chlorophenol appears as a colorless to amber liquid with an unpleasant, penetrating odor. Density 1.265 g / cm3. Sinks in water and slowly dissolves. Freezing point 7 °C (46 °F). Boiling point 175 °C (347 °F).

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