Basic information
- CAS
6037-23-6- Standard SMILES
CCOC(=O)C(CCc1ccccc1)C(=O)OCC[NH+](CC)CC.[Br-]- InChIKey
DCHUDXOBJXERCD-UHFFFAOYSA-N- Molecular formula
- C19H30BrNO4
- Average molar mass
- 416.3 g/mol
- Monoisotopic mass
- 415.13582
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl ethyl (2-phenylethyl)propanedioate--hydrogen bromide (1/1)
- IUPAC
- 2-(2-ethoxycarbonyl-4-phenylbutanoyl)oxyethyl-diethylazanium bromide
Names & synonyms
6037-23-6DTXSID909757782-(Diethylamino)ethyl ethyl (2-phenylethyl)propanedioate--hydrogen bromide (1/1)RefChem:1061708DTXCID201403172Ethylphenyl malonic acid 2-(diethylamino)ethyl ethyl ester hydrobromideEstere dietilaminoetilico dell'alliletilmalonato monoetilico bromidrato [Italian]MALONIC ACID, ETHYLPHENYL-, 2-(DIETHYLAMINO)ETHYL ETHYL ESTER, HYDROBROMIDEEstere dietilaminoetilico dell'alliletilmalonato monoetilico bromidrato
Database identifiers
- CAS
6037-23-6- PubChem CID
- 22396
Properties
Computed structural properties
- Topological polar surface area
- 57 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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