Basic information
- CAS
58038-59-8- Standard SMILES
O=C(OCCO)C(Oc1ccc(Cl)cc1)Oc1ccc(Cl)cc1- InChIKey
YIYCNCFDMMOPJD-UHFFFAOYSA-N- Molecular formula
- C16H14Cl2O5
- Average molar mass
- 357.2 g/mol
- Monoisotopic mass
- 356.0218289
Names & identifiers
- Preferred name
- Acetic acid, bis(4-chlorophenoxy)-, 2-hydroxyethyl ester
- IUPAC
- 2-hydroxyethyl 2,2-bis(4-chlorophenoxy)acetate
Names & synonyms
2-Hydroxyethyl bis(4-chlorophenoxy)acetateAcetic acid, bis(4-chlorophenoxy)-, 2-hydroxyethyl ester58038-59-8Di-p-chlorophenoxy-2,2 acetate d'hydroxy-2 ethyle [French]DTXSID10206758Di-p-chlorophenoxy-2,2 acetate d'hydroxy-2 ethyleRefChem:316553DTXCID40129249
Database identifiers
- CAS
58038-59-8- PubChem CID
- 3045019
- DTXSID
DTXSID10206758
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 65 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 328
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…