Basic information
- CAS
2437-55-0- Standard SMILES
Clc1ccc(Cl)c2c(Cl)cccc12- InChIKey
VQSNXLCFFHGXTI-UHFFFAOYSA-N- Molecular formula
- C10H5Cl3
- Average molar mass
- 231.5 g/mol
- Monoisotopic mass
- 229.945683
Names & identifiers
- Preferred name
- 1,4,5-Trichloronaphthalene
- IUPAC
- 1,4,5-trichloronaphthalene
- English name
- 1,4,5-TRICHLORONAPHTHALENE
- Molecular formula
- C10H5Cl3
- Molecular weight
- 231.51
Names & synonyms
1,4,5-TrichloronaphthaleneNaphthalene, 1,4,5-trichloro2437-55-0Naphthalene, 1,4,5-trichloro-1.4.5-Trichlor-naphthalinSCHEMBL7758357SCHEMBL20356035SCHEMBL30366723DTXSID10179115PCN-23
Database identifiers
- CAS
2437-55-0- PubChem CID
- 154262
- DTXSID
DTXSID10179115- Nikkaji
- J136.470G
Properties
Computed structural properties
- XLogP
- 5.3
- 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
- Henry's Law Constant
- 2.2 · 2.2×10-1 mol/(m3Pa) at 25℃, Odabasi and Adali (2016)
Chemistry & industry
Applications
Uses1,4,5-Trichloronaphthalene-13C10 is 13C labeled 1,4,5-Trichloronaphthalene[1].
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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