Basic information
- CAS
53404-24-3- Standard SMILES
CC(C)c1ccc2c(c1)CC[C@H]1[C@](C)(CN)CCC[C@]21C.CCCCC(CC)C(=O)O- InChIKey
MBVKWXSVKWAOKX-WFBUOHSLSA-N- Molecular formula
- C28H47NO2
- Average molar mass
- 429.7 g/mol
- Monoisotopic mass
- 429.36067974
Names & identifiers
- Preferred name
- Copper dehydroabietylammonium 2-ethylhexanoate
- IUPAC
- [(1R,4aS,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine;2-ethylhexanoic acid
Names & synonyms
Copper dehydroabietylammonium 2-ethylhexanoate53404-24-3Caswell No. 236EPA Pesticide Chemical Code 041202Copper dehydroabietyl ammonium 2-ethylhexanoateCopper dihydroabietyl ammonium 2-ethylhexanoateSCHEMBL5933872
Database identifiers
- CAS
53404-24-3- PubChem CID
- 62033
Properties
Computed structural properties
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 475
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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