2-(2-Chloroethyl)-1,3-dimethoxybenzene
Basic information
- CAS
16929-54-7- Standard SMILES
COc1cccc(OC)c1CCCl- InChIKey
HXRCCEHPVGBGHJ-UHFFFAOYSA-N- Molecular formula
- C10H13ClO2
- Average molar mass
- 200.66 g/mol
- Monoisotopic mass
- 200.0604073
Names & identifiers
- Preferred name
- 2-(2-Chloroethyl)-1,3-dimethoxybenzene
- IUPAC
- 2-(2-chloroethyl)-1,3-dimethoxybenzene
Names & synonyms
16929-54-72-(2-chloroethyl)-1,3-dimethoxybenzeneNSC141196Benzene,2-(2-chloroethyl)-1,3-dimethoxy-DTXSID50301115NSC-141196DS-010027
Database identifiers
- CAS
16929-54-7- PubChem CID
- 284880
- DTXSID
DTXSID50301115
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 129
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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