Basic information
- CAS
69462-13-1- Standard SMILES
CNC.O=C(O)Cc1c(Cl)ccc(Cl)c1Cl- InChIKey
BFOKWPRDYWIYBS-UHFFFAOYSA-N- Molecular formula
- C10H12Cl3NO2
- Average molar mass
- 284.6 g/mol
- Monoisotopic mass
- 282.993362
Names & identifiers
- Preferred name
- 2,3,6-Trichlorophenylacetic acid dimethylamine salt
- IUPAC
- N-methylmethanamine;2-(2,3,6-trichlorophenyl)acetic acid
Names & synonyms
69462-13-12,3,6-Trichlorophenylacetic acid dimethylamine salt2,4,5-t DimethylammoniumDimethylamine 2,3,6-trichlorophenylacetateOQE98LYN9OCaswell No. 882BUNII-OQE98LYN9OEPA Pesticide Chemical Code 0826052,3,6-Trichlorophenylacetic acid, dimethylamine saltMethanamine, N-methyl-, 2,3,6-trichlorobenzeneacetateAcetic acid, (2,3,6-trichlorophenyl)-, salt with ME2NHDTXSID0075025
Show more names
SCHEMBL31349920Q27285787(2,3,6-Trichlorophenyl)acetic acid--N-methylmethanamine (1/1)
Database identifiers
- CAS
69462-13-1- PubChem CID
- 62255
- DTXSID
DTXSID0075025- UNII
- OQE98LYN9O
Properties
Computed structural properties
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 201
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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