1-(Pentachlorophenyl)ethyl acetate
Basic information
- CAS
65426-67-7- Standard SMILES
CC(=O)OC(C)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl- InChIKey
AUYUFOAJKQTOEM-UHFFFAOYSA-N- Molecular formula
- C10H7Cl5O2
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 333.888868
Names & identifiers
- Preferred name
- 1-(Pentachlorophenyl)ethyl acetate
- IUPAC
- 1-(2,3,4,5,6-pentachlorophenyl)ethyl acetate
Names & synonyms
65426-67-71-(pentachlorophenyl)ethyl acetateNSC73605DTXSID60291174NSC-73605
Database identifiers
- CAS
65426-67-7- PubChem CID
- 252241
- DTXSID
DTXSID60291174
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…