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1,2,3,4-Tetrachloronaphthale

CAT: 1596-AR-N08307-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAS Number
20020-02-4
Molecular Formula
C18H12D6ClIN6O4
Molecular Weight
265.94
API Name
Naphthalene

Chemical Information

1,2,3,4-Tetrachloronaphthalene

Tetrachloronaphthalene is a colorless to pale-yellow solid with an intense aromatic odor. Melting Point :182 C. Presents an environmental danger. Used in lubricants and in the manufacture of insulation for electrical wire. If released into the environment, bioaccumulation takes place in fish. Will persist in the environment causing long-term adverse effects. The halowaxes are technical-grade chlorinated naphthalenes containing tetrachloronaphthalene in its various isomers together with (mainly) trichloro- pentachloro- and hexa-chloronapthalenes in their various isomers.

CAS Number20020-02-4
PubChem CID29910
IUPAC Name1,2,3,4-tetrachloronaphthalene
Molecular FormulaC10H4Cl4
Molecular Weight265.9
XLogP5.7
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity186
SMILES
C1=CC=C2C(=C1)C(=C(C(=C2Cl)Cl)Cl)Cl
InChI
InChI=1S/C10H4Cl4/c11-7-5-3-1-2-4-6(5)8(12)10(14)9(7)13/h1-4H
InChIKey
NAQWICRLNQSPPW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,2,3,4-Tetrachloronaphthalene
CAS: 20020-02-4
CID: 29910
Formula: C10H4Cl4
MW: 265.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight265.9
XLogP35.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass265.903761
Monoisotopic Mass263.906711
Topological Polar Surface Area0 Ų
Heavy Atom Count14
Formal Charge0
Complexity186
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