95-57-8

Name 2-Chlorophenol
CAS 95-57-8
EINECS(EC#) 202-433-2
Molecular Formula C6H5ClO
MDL Number MFCD00002159
Molecular Weight 128.56
MOL File 95-57-8.mol

Chemical Properties

Appearance All isomers have a characteristic odor.
Melting point  8 °C (lit.)
Boiling point  175-176 °C (lit.)
density  1.241 g/mL at 25 °C(lit.)
vapor pressure  13.3 hPa (50 °C)
refractive index  n20/D 1.558(lit.)
Fp  147 °F
storage temp.  0-6°C
solubility  alcohol: freely soluble
form  neat
pka 8.49(at 25℃)
color  Clear Colourless to Pale Orange
Stability: Stable. Hygroscopic. Combustible. Incompatible with oxidizing agents, acid anhydrides, acid chlorides.
Water Solubility  28.5 g/L (20 ºC)
Specific Heat Capacity Cp(liquid):188.7J/(g·K),at 25℃
Merck  14,2154
BRN  1905114
Henry's Law Constant 6.44 x 10-6 atm?m3/mol at 20 °C (Sheikheldin et al., 2001)
Dielectric constant 8.2(19℃)
Major Application agriculture
environmental
InChI 1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChIKey ISPYQTSUDJAMAB-UHFFFAOYSA-N
SMILES Oc1ccccc1Cl
LogP 2.18 at 20℃
Uses
Organic synthesis (dyes).
CAS DataBase Reference 95-57-8(CAS DataBase Reference)
NIST Chemistry Reference 2-Chlorophenol(95-57-8)
EPA Substance Registry System 95-57-8(EPA Substance)

Safety Data

Symbol(GHS)  Corrosion (GHS05)Skull and Crossbones (GHS06)Environment (GHS09)
GHS05,GHS06,GHS09
Signal word  Danger
Hazard statements  H302-H311+H331-H314-H411
Precautionary statements  P273-P280-P301+P312-P303+P361+P353-P304+P340+P310-P305+P351+P338
Hazard Codes  Xn,N,T,F
Risk Statements 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R39/23/24/25:Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed .
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R11:Highly Flammable.
Safety Statements 
S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves .
S16:Keep away from sources of ignition-No smoking .
S7:Keep container tightly closed .
RIDADR  UN 2021 6.1/PG 3
WGK Germany  2
RTECS  SK2625000
F  9
Autoignition Temperature 550 °C
TSCA  Yes
REACH Registrations Active
HazardClass  6.1
PackingGroup  III
HS Code  29081000
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Aquatic Chronic 2
Eye Dam. 1
Skin Corr. 1B
Safety Profile
Poison by ingestion, intraperitoneal, and intravenous routes. Experimental reproductive effects. Questionable carcinogen with experimental tumorigenic data. Mutation data reported. Flammable liquid when exposed to heat, flame, or oxidizers. To fight fire, use alcohol foam. When heated to decomposition it emits toxic fumes of Cl-. See also CHLOROPHENOLS and CHLORIDES.
Hazardous Substances Data 95-57-8(Hazardous Substances Data)
Toxicity
LD50 orally in rats: 0.67 g/kg (Deichmann)

Hazard Information

Material Safety Data Sheet(MSDS)

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