Acetic acid, (4-chloro-2-methylphenoxy)-, butyl ester, mixt. with pentyl (2,4,5-trichlorophenoxy)acetate
Basic information
- CAS
8064-18-4- Standard SMILES
CCCCCOC(=O)COc1cc(Cl)c(Cl)cc1Cl.CCCCOC(=O)COc1ccc(Cl)cc1C- InChIKey
CLNMVBDOFHGIOJ-UHFFFAOYSA-N- Molecular formula
- C26H32Cl4O6
- Average molar mass
- 582.3 g/mol
- Monoisotopic mass
- 580.0953
Names & identifiers
- Preferred name
- Acetic acid, (4-chloro-2-methylphenoxy)-, butyl ester, mixt. with pentyl (2,4,5-trichlorophenoxy)acetate
- IUPAC
- butyl 2-(4-chloro-2-methylphenoxy)acetate;pentyl 2-(2,4,5-trichlorophenoxy)acetate
Names & synonyms
TselatoxCelatoxAcetic acid, (4-chloro-2-methylphenoxy)-, butyl ester, mixt. with pentyl (2,4,5-trichlorophenoxy)acetateDTXSID50230451RefChem:316259DTXCID501529428064-18-4TSLTSCHEMBL29460353Butyl (4-chloro-2-methylphenoxy)acetate--pentyl (2,4,5-trichlorophenoxy)acetate (1/1)
Database identifiers
- CAS
8064-18-4- PubChem CID
- 24716
- DTXSID
DTXSID50230451
Properties
Computed structural properties
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 15
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 509
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Compound notes
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