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1,2,8-Trichloronaphthalene

HCID 154371
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Basic information

CAS
55720-35-9
Standard SMILES
Clc1ccc2cccc(Cl)c2c1Cl
InChIKey
YSFLKFZEQBZEPU-UHFFFAOYSA-N
Molecular formula
C10H5Cl3
Average molar mass
231.5 g/mol
Monoisotopic mass
229.945683

Names & identifiers

Preferred name
1,2,8-Trichloronaphthalene
IUPAC
1,2,8-trichloronaphthalene
English name
1,2,8-TRICHLORONAPHTHALENE
Molecular formula
C10H5Cl3
Molecular weight
231.51

Names & synonyms

1,2,8-Trichloronaphthalene55720-35-9Naphthalene, 1,2,8-trichloroNaphthalene, 1,2,8-trichloro-SCHEMBL1392392SCHEMBL20356034DTXSID80204261

Database identifiers

CAS
55720-35-9
PubChem CID
154371
DTXSID
DTXSID80204261
Nikkaji
J167.203G

Properties

Computed structural propertiesFilling in

XLogP
5.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
183

Physicochemical properties

Melting point
84 °C · 84 °C
Boiling point
322.3 · 322.3±22.0 °C(Predicted)
Density
1.452 · 1.452±0.06 g/cm3(Predicted)

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