Basic information
- CAS
82845-34-9- Standard SMILES
CCC(CC)C(=O)NC(=O)NC(N)=O- InChIKey
VNWJSMHISFGJBS-UHFFFAOYSA-N- Molecular formula
- C8H15N3O3
- Average molar mass
- 201.22 g/mol
- Monoisotopic mass
- 201.11134135
Names & identifiers
- Preferred name
- N-(Carbamoylcarbamoyl)-2-ethyl-butanamide
- IUPAC
- N-(carbamoylcarbamoyl)-2-ethylbutanamide
Names & synonyms
Diethylacetylbiuret82845-34-9N-(CARBAMOYLCARBAMOYL)-2-ETHYL-BUTANAMIDEBiuret, 1-(2-ethylbutyryl)-NIOSH/NJ6858000NJ68580000N-(2-Ethyl-1-oxobutyl)imidodicarbonic diamideImidodicarbonic diamide, N-(2-ethyl-1-oxobutyl)-N-(carbamoylcarbamoyl)-2-ethylbutanamideDTXSID10320908VNWJSMHISFGJBS-UHFFFAOYSA-NNSC366158
Show more names
NSC-3661581-Aminocarbonyl-3-(2-ethyl-butanoyl)-ureaDS-011660N-(2-Ethylbutanoyl)dicarbonimidic diamide #
Database identifiers
- CAS
82845-34-9- PubChem CID
- 339458
- DTXSID
DTXSID10320908
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 236
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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