2-[2-(2-Chloroethoxy)ethoxy]-1-methyl-4-(propan-2-yl)benzene
Basic information
- CAS
7462-31-9- Standard SMILES
Cc1ccc(C(C)C)cc1OCCOCCCl- InChIKey
NMTNRIGJALFQNR-UHFFFAOYSA-N- Molecular formula
- C14H21ClO2
- Average molar mass
- 256.77 g/mol
- Monoisotopic mass
- 256.1230076
Names & identifiers
- Preferred name
- 2-[2-(2-Chloroethoxy)ethoxy]-1-methyl-4-(propan-2-yl)benzene
- IUPAC
- 2-[2-(2-chloroethoxy)ethoxy]-1-methyl-4-propan-2-ylbenzene
Names & synonyms
7462-31-9NSC404200DTXSID203235262-[2-(2-Chloroethoxy)ethoxy]-1-methyl-4-(propan-2-yl)benzeneAKOS012976728NSC-404200
Database identifiers
- CAS
7462-31-9- PubChem CID
- 346138
- DTXSID
DTXSID20323526
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…