Basic information
- CAS
53404-47-0- Standard SMILES
CCCCCCCCCCCCN.C[As](=O)(O)O- InChIKey
YVSWXQSYQGAPTM-UHFFFAOYSA-N- Molecular formula
- C13H32AsNO3
- Average molar mass
- 325.32 g/mol
- Monoisotopic mass
- 325.159813
Names & identifiers
- Preferred name
- Arsonic acid, methyl-, compd. with 1-dodecanamine (1:1)
- IUPAC
- dodecan-1-amine;methylarsonic acid
- English name
- Dodecylammoniummethanearsonate
- Molecular formula
- C12H27N.CH5AsO3
- Molecular weight
- 325.32
Names & synonyms
Dodecylammonium methanearsonate53404-47-01-Dodecanamine, methylarsonate (1:1)0512Y5266PRefChem:1077232Caswell No. 413BEPA Pesticide Chemical Code 013805UNII-0512Y5266PDDAMASCHEMBL5933438DTXSID7058410Methylarsonic acid--dodecan-1-amine (1/1)
Show more names
Dodecylammoniummethanearsonate
Q27236052
Database identifiers
- CAS
53404-47-0- PubChem CID
- 62043
- DTXSID
DTXSID7058410- UNII
- 0512Y5266P
Properties
Computed structural properties
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 142
Physicochemical properties
- FDA UNII
- 512 Y5266P · 0512Y5266P
- EPA Substance Registry System
- Dodecylammonium methanearsonate (53404-47-0)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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