Acetic acid, (2,4-dichlorophenoxy)-, 1-methylpropyl ester
Basic information
- CAS
94-79-1- Standard SMILES
CCC(C)OC(=O)COc1ccc(Cl)cc1Cl- InChIKey
PVVPYVMHXYPBQZ-UHFFFAOYSA-N- Molecular formula
- C12H14Cl2O3
- Average molar mass
- 277.14 g/mol
- Monoisotopic mass
- 276.0319997
Names & identifiers
- Preferred name
- Acetic acid, (2,4-dichlorophenoxy)-, 1-methylpropyl ester
- IUPAC
- butan-2-yl 2-(2,4-dichlorophenoxy)acetate
- English name
- 2,4-Dichlorophenoxy-1-methyl propanoate
- Molecular formula
- C10H10Cl2O2
- Molecular weight
- 0
Names & synonyms
94-79-12,4-D sec-butyl esterbutan-2-yl 2-(2,4-dichlorophenoxy)acetateAcetic acid, (2,4-dichlorophenoxy)-, 1-methylpropyl ester1-Methylpropyl 2-(2,4-dichlorophenoxy)acetateAcetic acid, (2,4-dichlorophenoxy)-, sec-butyl esterDTXSID60916714s-butyl 2,4-dichloro-phenoxyacetate2,4-D 1-METHYLPROPYL ESTERsec-butyl 2,4-dichloro-phenoxyacetateButan-2-yl (2,4-dichlorophenoxy)acetatebutan-2-yl 2-(2,4-dichlorophenoxy)acetate;(2,4-DICHLOROPHENOXY)ACETIC ACID, 1-METHYLPROPYL ESTER);2,4-D 1-Methylpropyl ester;Acetic acid, (2,4-dichlorophenoxy)-, 1-methylpropyl ester;Acetic acid, (2,4-dichlorophenoxy)-, sec-butyl ester
Database identifiers
- CAS
94-79-1- PubChem CID
- 60981
- DTXSID
DTXSID60916714
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 248
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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