1-Chloro-3-[(4-methylphenoxy)methyl]benzene
Basic information
- CAS
6279-15-8- Standard SMILES
Cc1ccc(OCc2cccc(Cl)c2)cc1- InChIKey
VYGXRWGMEIKQHM-UHFFFAOYSA-N- Molecular formula
- C14H13ClO
- Average molar mass
- 232.7 g/mol
- Monoisotopic mass
- 232.0654927
Names & identifiers
- Preferred name
- 1-Chloro-3-[(4-methylphenoxy)methyl]benzene
- IUPAC
- 1-chloro-3-[(4-methylphenoxy)methyl]benzene
Names & synonyms
1-chloro-3-[(4-methylphenoxy)methyl]benzene6279-15-8NSC111781-[(3-chlorophenyl)methoxy]-4-methylbenzeneSCHEMBL6335202SCHEMBL10169470DTXSID50279067NSC-11178AKOS008912896
Database identifiers
- CAS
6279-15-8- PubChem CID
- 223497
- DTXSID
DTXSID50279067
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 199
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Compound notes
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