Basic information
- CAS
5457-81-8- Standard SMILES
COC(=O)CCC(C)=NNC(N)=O- InChIKey
DLPCAZQAWXZGFM-UHFFFAOYSA-N- Molecular formula
- C7H13N3O3
- Average molar mass
- 187.2 g/mol
- Monoisotopic mass
- 187.09569129
Names & identifiers
- Preferred name
- methyl (4E)-4-(carbamoylhydrazinylidene)pentanoate
- IUPAC
- methyl 4-(carbamoylhydrazinylidene)pentanoate
Names & synonyms
5457-81-8methyl (4E)-4-(carbamoylhydrazinylidene)pentanoatemethyl 4-(2-carbamoylhydrazinylidene)pentanoateDTXSID70282038
Database identifiers
- CAS
5457-81-8- PubChem CID
- 229876
- DTXSID
DTXSID70282038
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 93.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 225
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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