Ammonium, (3,5-dihydroxyphenyl)trimethyl-, bromide, bis(dimethylcarbamate) (ester)
Basic information
- CAS
66941-37-5- Standard SMILES
CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc([N+](C)(C)C)c1.[Br-]- InChIKey
VHFDMRCMOKLCJR-UHFFFAOYSA-M- Molecular formula
- C15H24BrN3O4
- Average molar mass
- 390.27 g/mol
- Monoisotopic mass
- 389.09502
Names & identifiers
- Preferred name
- Ammonium, (3,5-dihydroxyphenyl)trimethyl-, bromide, bis(dimethylcarbamate) (ester)
- IUPAC
- [3,5-bis(dimethylcarbamoyloxy)phenyl]-trimethylazanium bromide
Names & synonyms
66941-37-5Ro 2-0708(3,5-Dihydroxyphenyl)trimethylammonium bromide bis(dimethylcarbamate) (ester)Ammonium, (3,5-dihydroxyphenyl)trimethyl-, bromide, bis(dimethylcarbamate) (ester)RefChem:318828DTXSID009856613,5-bis[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium bromide
Database identifiers
- CAS
66941-37-5- PubChem CID
- 48500
- DTXSID
DTXSID00985661
Properties
Computed structural properties
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 374
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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