Basic information
- CAS
854731-67-2- Standard SMILES
CCOC(=O)N(N=O)C1CCCC1- InChIKey
KDZHVZRDBYKCEF-UHFFFAOYSA-N- Molecular formula
- C8H14N2O3
- Average molar mass
- 186.21 g/mol
Names & identifiers
- Preferred name
- Ethyl cyclopentyl(nitroso)carbamate
- IUPAC
- ethyl N-cyclopentyl-N-nitrosocarbamate
- English name
- Cyclopentanecarbamic acid, N-nitroso-, ethyl ester (5CI)
- Molecular formula
- C8H14N2O3
- Molecular weight
- 186.20836
Names & synonyms
Ethyl cyclopentyl(nitroso)carbamate854731-67-2Cyclopentanecarbamic acid, N-nitroso-, ethyl ester (5CI)
Database identifiers
- CAS
854731-67-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Boiling point
- 239.7 · 239.7±23.0 °C(Predicted)
- Density
- 1.1016 g/cm3 · 1.1016 g/cm3(Temp: 25 °C)
- pka
- -2.82 · -2.82±0.20(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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