2-(Trichloromethyl)phenol
Basic information
- CAS
69911-63-3- Standard SMILES
Oc1ccccc1C(Cl)(Cl)Cl- InChIKey
OLXZIGFHNNMHOE-UHFFFAOYSA-N- Molecular formula
- C7H5Cl3O
- Average molar mass
- 211.5 g/mol
- Monoisotopic mass
- 209.940598
Names & identifiers
- Preferred name
- 2-(Trichloromethyl)phenol
- IUPAC
- 2-(trichloromethyl)phenol
Names & synonyms
2-(Trichloromethyl)phenolDTXSID9061134669911-63-3RefChem:254855DTXCID30562101TrichlorkresolSCHEMBL7190827SCHEMBL7190832SCHEMBL30475078
Database identifiers
- CAS
69911-63-3- PubChem CID
- 21200918
- DTXSID
DTXSID90611346
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
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Compound notes
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