Ammonium, benzyltriethyl-, cyanoacetate
Basic information
- CAS
73680-66-7- Standard SMILES
CC[N+](CC)(CC)Cc1ccccc1.N#CCC(=O)[O-]- InChIKey
KAVSGWYQMWQAKM-UHFFFAOYSA-M- Molecular formula
- C16H24N2O2
- Average molar mass
- 276.37 g/mol
- Monoisotopic mass
- 276.18377801
Names & identifiers
- Preferred name
- Ammonium, benzyltriethyl-, cyanoacetate
- IUPAC
- benzyl(triethyl)azanium;2-cyanoacetate
Names & synonyms
Benzyltriethylammonium cyanoacetate73680-66-7AMMONIUM, BENZYLTRIETHYL-, CYANOACETATENSC 221295Ammonium, (benzyltriethyl)-, cyanoacetateDTXSID80223937Benzenemethanaminium, N,N,N-triethyl-, salt with cyanoacetic acid (1:1)RefChem:319176DTXCID10146428Benzenemethanaminium, N,N,N-triethyl-, salt with cyanoacetic acid (1:1) (9CI)N-Benzyl-N,N-diethylethanaminium cyanoacetate
Database identifiers
- CAS
73680-66-7- PubChem CID
- 52127
- DTXSID
DTXSID80223937
Properties
Computed structural properties
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 228
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…