Basic information
- CAS
39719-59-0- Standard SMILES
O=C(COc1ccc(Cl)cc1)OCC(O)COc1ccc(Cl)cc1- InChIKey
ODBNWGMVGAERAT-UHFFFAOYSA-N- Molecular formula
- C17H16Cl2O5
- Average molar mass
- 371.2 g/mol
- Monoisotopic mass
- 370.037479
Names & identifiers
- Preferred name
- 3-(4-Chlorophenoxy)-2-hydroxypropyl (4-chlorophenoxy)acetate
- IUPAC
- [3-(4-chlorophenoxy)-2-hydroxypropyl] 2-(4-chlorophenoxy)acetate
Names & synonyms
3-(4-Chlorophenoxy)-2-hydroxypropyl (4-chlorophenoxy)acetateDTXSID9096032139719-59-0RefChem:1066803DTXCID301388181BRN 3006371Acetic acid, (4-chlorophenoxy)-, 3-(4-chlorophenoxy)-2-hydroxypropyl ester
Database identifiers
- CAS
39719-59-0- PubChem CID
- 217835
- DTXSID
DTXSID90960321
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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