Dodecyl 4-(carbamoylamino)-4-oxobut-2-enoate
Basic information
- CAS
198899-93-3- Standard SMILES
CCCCCCCCCCCCOC(=O)C=CC(=O)NC(N)=O- InChIKey
OUWYXJOKJCFDQF-UHFFFAOYSA-N- Molecular formula
- C17H30N2O4
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.22055744
Names & identifiers
- Preferred name
- Dodecyl 4-(carbamoylamino)-4-oxobut-2-enoate
- IUPAC
- dodecyl 4-(carbamoylamino)-4-oxobut-2-enoate
Names & synonyms
dodecyl 4-(carbamoylamino)-4-oxobut-2-enoateDTXSID2013522204-[(Aminocarbonyl)amino]-4-oxo-2-butenoic acid dodecyl ester198899-93-3
Database identifiers
- CAS
198899-93-3- PubChem CID
- 229922
- DTXSID
DTXSID201352220
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 98.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 381
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Compound notes
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