MCPA diolamine salt
Basic information
- CAS
20405-19-0- Standard SMILES
Cc1cc(Cl)ccc1OCC(=O)O.OCCNCCO- InChIKey
XQAVWNJMMDWIKG-UHFFFAOYSA-N- Molecular formula
- C13H20ClNO5
- Average molar mass
- 305.75 g/mol
- Monoisotopic mass
- 305.1030004
Names & identifiers
- Preferred name
- MCPA diolamine salt
- IUPAC
- 2-(4-chloro-2-methylphenoxy)acetic acid;2-(2-hydroxyethylamino)ethanol
Names & synonyms
MCPA-diolamine20405-19-0QDC7T32U4IMCPA diolamine saltRefChem:1088888243-792-5MCPA-diolamine [ISO]Bis(2-hydroxyethyl)ammonium 4-chloro-o-tolyloxyacetateCaswell No. 557EMCPA diethanolamine saltEINECS 243-792-5MCPA, diethanolamine salt
Show more names
UNII-QDC7T32U4IEPA Pesticide Chemical Code 030511MCPA DIOLAMINE(2-Methyl-4-chlorophenoxy)acetic acid, diethanolamine saltDiethanolamine 2-methyl-4-chlorophenoxyacetateSCHEMBL5480314DTXSID7058331Q27287211
Database identifiers
- CAS
20405-19-0- PubChem CID
- 62741
- DTXSID
DTXSID7058331- UNII
- QDC7T32U4I
- EC Number
- 243-792-5
Properties
Computed structural properties
- Topological polar surface area
- 99 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 213
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Related reactions
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Compound notes
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