Phenol, 4-(2,2-dichloroethenyl)-
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Basic information
- CAS
83671-20-9- Standard SMILES
Oc1ccc(C=C(Cl)Cl)cc1- InChIKey
DQQXPDAVLLJOGV-UHFFFAOYSA-N- Molecular formula
- C8H6Cl2O
- Average molar mass
- 189.04 g/mol
- Monoisotopic mass
- 187.9795702
Names & identifiers
- Preferred name
- Phenol, 4-(2,2-dichloroethenyl)-
- IUPAC
- 4-(2,2-dichloroethenyl)phenol
- English name
- 4-(2,2-Dichlorovinyl)phenol
- Molecular formula
- C8H6Cl2O
- Molecular weight
- 189.04
Names & synonyms
4-(2,2-dichloroethenyl)phenolPhenol, 4-(2,2-dichloroethenyl)-83671-20-94-(2,2-dichlorovinyl)phenol4-dichlorovinylphenolSCHEMBL3755558DTXSID10415969DQQXPDAVLLJOGV-UHFFFAOYSA-Np-hydroxy-beta,beta-dichlorostyrene4-(2,2-Dichloroethen-1-yl)phenolDB-304883InChI=1/C8H6Cl2O/c9-8(10)5-6-1-3-7(11)4-2-6/h1-5,11
Show more names
p-(2,2-Dichlorovinyl)phenolβ,β-Dichloro-4-hydroxystyrene4-(2,2-Dichloroethenyl)phenol (VS)1,1-Dichloro-2-(4-hydroxyphenyl)ethene
Database identifiers
- CAS
83671-20-9- PubChem CID
- 5324901
- DTXSID
DTXSID10415969- Nikkaji
- J68.171G
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Physicochemical properties
- Boiling point
- 277.8 · 277.8±25.0 °C(Predicted)
- Density
- 1.401 · 1.401±0.06 g/cm3(Predicted)
- pka
- 9.42 · 9.42±0.26(Predicted)
Related reactions
3 records
Compound notes
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