Basic information
- Standard SMILES
CCCCOC(=O)NC(N)=O- InChIKey
RNXRXBFLIGLDTC-UHFFFAOYSA-N- Molecular formula
- C6H12N2O3
- Average molar mass
- 160.17 g/mol
Names & identifiers
- Preferred name
- n-Butyl allophanate
- IUPAC
- butyl N-carbamoylcarbamate
Names & synonyms
n-Butyl allophanatebutyl allophanateSCHEMBL4451188RNXRXBFLIGLDTC-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 5315565
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 147
Related reactions
1 records
Compound notes
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