2-Chloro-4-[2-(3-chloro-4-hydroxyphenyl)-2-bicyclo[2.2.1]heptanyl]phenol
Basic information
- CAS
47253-09-8- Standard SMILES
Oc1ccc(C2(c3ccc(O)c(Cl)c3)CC3CCC2C3)cc1Cl- InChIKey
XFWTYSLRYZAOMG-UHFFFAOYSA-N- Molecular formula
- C19H18Cl2O2
- Average molar mass
- 349.2 g/mol
- Monoisotopic mass
- 348.0683852
Names & identifiers
- Preferred name
- 2-Chloro-4-[2-(3-chloro-4-hydroxyphenyl)-2-bicyclo[2.2.1]heptanyl]phenol
- IUPAC
- 2-chloro-4-[2-(3-chloro-4-hydroxyphenyl)-2-bicyclo[2.2.1]heptanyl]phenol
Names & synonyms
NSC32843647253-09-8DTXSID80318291NSC-3284364,4'-(Bicyclo[2.2.1]heptane-2,2-diyl)bis(2-chlorophenol)
Database identifiers
- CAS
47253-09-8- PubChem CID
- 332250
- DTXSID
DTXSID80318291- Nikkaji
- J1.340.232I
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 417
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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