Basic information
- CAS
2212-53-5- Standard SMILES
CCCCCCCCN.O=C(O)COc1ccc(Cl)cc1Cl- InChIKey
ISLMFQNVUXMPKH-UHFFFAOYSA-N- Molecular formula
- C16H25Cl2NO3
- Average molar mass
- 350.3 g/mol
- Monoisotopic mass
- 349.121149
Names & identifiers
- Preferred name
- Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with 1-octanamine (1:1)
- IUPAC
- 2-(2,4-dichlorophenoxy)acetic acid;octan-1-amine
Names & synonyms
2212-53-5RefChem:1075714Acetic acid, 2-(2,4-dichlorophenoxy)-, compd. with 1-octanamine (1:1)2,4-D octylamine saltOctylamine 2,4-dichlorophenoxyacetateCaswell No. 315Z2,4-D, octylamine saltEPA Pesticide Chemical Code 030030Octylamine (2,4-dichlorophenoxy)acetate2,4-Dichlorophenoxyacetic acid octylamine saltSCHEMBL1179452DTXSID2058332
Show more names
SCHEMBL307042342,4-D, octylamine salt (1:1)(2,4-Dichlorophenoxy)acetic acid--octan-1-amine (1/1)
Database identifiers
- CAS
2212-53-5- PubChem CID
- 62437
- DTXSID
DTXSID2058332
Properties
Computed structural properties
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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