Basic information
- CAS
56141-00-5- Standard SMILES
COc1c(Cl)cc(Cl)cc1C(=O)OCCN(CCOC(=O)c1c(Cl)ccc(Cl)c1OC)c1ccccc1- InChIKey
RCOHXZITQFQFRZ-UHFFFAOYSA-N- Molecular formula
- C26H23Cl4NO6
- Average molar mass
- 587.3 g/mol
- Monoisotopic mass
- 585.027948
Names & identifiers
- Preferred name
- Cambendichlor
- IUPAC
- 2-[N-[2-(3,5-dichloro-2-methoxybenzoyl)oxyethyl]anilino]ethyl 3,6-dichloro-2-methoxybenzoate
- English name
- Cambendichlor
- Molecular formula
- C26H23Cl4NO6
- Molecular weight
- 587.28
Names & synonyms
53TQJ1MN7RDTXSID70971511RefChem:1080738DTXCID60139902256141-00-5CambendichlorBenzoic acid, 3,6-dichloro-2-methoxy-, (phenylimino)di-2,1-ethanediyl esterCambendichloreCambendichlor [ANSI]Cambendichlor [ANSI:ISO]UNII-53TQJ1MN7RCAMBENDICHLOR [ISO]
Show more names
VEL-4207BendichlorCambendiclorBis(3,6-dichloro-2-methoxybenzoic acid)phenyliminobisethylene esterBis(3,6-dichloro-2-methoxybenzoic acid)(phenylimino)di-2,1-ethanediyl ester
SCHEMBL5933809SCHEMBL31598875N-Phenyldiethanolamine bis(2-methoxy-3,6-dichlorobenzoate)(Phenylimino)di-2,1-ethanediyl 3,6-dichloro-2-methoxybenzoateVEL 4207Benzoic acid, 3,6-dichloro-2-methoxy-, ester with N-phenyldiethanolamine (2:1)2-[{2-[(3,6-dichloro-2-methoxybenzoyl)oxy]ethyl}(phenyl)amino]ethyl 3,5-dichloro-2-methoxybenzoateQ27261128
Database identifiers
- CAS
56141-00-5- PubChem CID
- 41745
- DTXSID
DTXSID70971511- UNII
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 727
Physicochemical properties
- Boiling point
- 685.5 · 685.5±55.0 °C(Predicted)
- Density
- 1.395 · 1.395±0.06 g/cm3(Predicted)
- pka
- 4.03 · 4.03±0.50(Predicted)
- FDA UNII
- 53 TQJ1MN7R · 53TQJ1MN7R
- EPA Substance Registry System
- Cambendichlor (56141-00-5)
Chemistry & industry
Applications
DescriptionCambendichlor is an obsolete herbicide. Data relating to its environmental fate, ecotoxicology and human health effects are very scarce.
UsesCambendichlor is used as a herbicide for agricultural purposes.
Suppliers2 total
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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