Basic information
- CAS
76206-36-5- Standard SMILES
CCN(N=O)C(=O)Oc1cccc2ccccc12- InChIKey
HLTSAAUNFXIGTA-UHFFFAOYSA-N- Molecular formula
- C13H12N2O3
- Average molar mass
- 244.25 g/mol
- Monoisotopic mass
- 244.08479225
Overview
structure in first source
Names & identifiers
- Preferred name
- 1-naphthyl-N-ethyl-N-nitrosocarbamate
- IUPAC
- naphthalen-1-yl N-ethyl-N-nitrosocarbamate
- English name
- 1-Naphthyl-N-ethyl-N-nitrosocarbamate
- Molecular formula
- C13H11N2O3-
- Molecular weight
- 243.23804
Names & synonyms
1-Naphthyl-N-ethyl-N-nitrosocarbamate76206-36-5DTXSID30227066RefChem:765421-NENCBDTXCID30149557N-Ethyl-N-nitrosocarbamic acid 1-naphthyl ester1-Naphthyl N-ethyl-N-nitrosocarbamateCARBAMIC ACID, ETHYLNITROSO-, 1-NAPHTHYL ESTERNaphthalen-1-yl ethyl(nitroso)carbamate
Database identifiers
- CAS
76206-36-5- PubChem CID
- 53463
- DTXSID
DTXSID30227066- Nikkaji
- J67.608J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- Boiling point
- 387.16 °C · 387.16°C (rough estimate)
- Density
- 1.2157 · 1.2157 (rough estimate)
- refractive index
- 1.645 · 1.6450 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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