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Basic information
- CAS
64046-52-2- Standard SMILES
C[NH+](C)CCOC(=O)COc1ccc(Cl)cc1Cl.[Cl-]- InChIKey
GFGAOQSSHHPCRD-UHFFFAOYSA-N- Molecular formula
- C12H16Cl3NO3
- Average molar mass
- 328.6 g/mol
- Monoisotopic mass
- 327.019576
Names & identifiers
- Preferred name
- Acetic acid, 2,4-dichlorophenoxy-, 2-dimethylaminoethyl ester, hydrochloride
- IUPAC
- 2-[2-(2,4-dichlorophenoxy)acetyl]oxyethyl-dimethylazanium chloride
Names & synonyms
64046-52-2ACETIC ACID, 2,4-DICHLOROPHENOXY-, 2-DIMETHYLAMINOETHYL ESTER, HYDROCHLORIDERefChem:10757082,4-Dichlorophenoxyacetic acid 2-dimethylaminoethyl ester hydrochloride
Database identifiers
- CAS
64046-52-2- PubChem CID
- 46637
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
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Compound notes
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