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2,5-Dichlorophenol 98%

CAT: 0286-D16310-02Size: 250 gDry Ice: NoHazardous: Yes
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CAT#:0286-D16310-02Size:250 g
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CAS Number
583-78-8
UN Code
UN2020
Pictogram
05 - Corrosive; 06 - Acute Toxicity
UDF Signal Word
Danger
MDL Number
MFCD00002174
Hazard Statement
H302 Harmful if swallowed; H311 Toxic in contact with skin; H314 Causes severe skin burns and eye damage; H318 Causes serious eye damage; H332 Harmful if inhaled.
DOT Name
Chlorophenols, Solid
DOT Classification
Class 6.1
Packaging Group
PGIII
Precautions
P260 Do not breathe dust/fume/gas/mist/vapors/spray; 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; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention.

Chemical Information

2,5-Dichlorophenol

2,5-dichlorophenol is a dichlorophenol with the chloro substituents at positions 2 and 5. It has a role as a human xenobiotic metabolite.

CAS Number583-78-8
PubChem CID66
IUPAC Name2,5-dichlorophenol
Molecular FormulaC6H4Cl2O
Molecular Weight163.00
XLogP3.1
Topological Polar Surface Area20.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count9
Formal Charge0
Complexity97
SMILES
C1=CC(=C(C=C1Cl)O)Cl
InChI
InChI=1S/C6H4Cl2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H
InChIKey
RANCECPPZPIPNO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dichlorophenol
CAS: 583-78-8
CID: 66
Formula: C6H4Cl2O
MW: 163.00
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight163.00
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass161.9639201
Monoisotopic Mass161.9639201
Topological Polar Surface Area20.2 Ų
Heavy Atom Count9
Formal Charge0
Complexity97.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes