Basic information
- CAS
62681-13-4- Standard SMILES
CCOC(=O)N(CCOC(C)=O)N=O- InChIKey
ZUPMZPDNCIDBJG-UHFFFAOYSA-N- Molecular formula
- C7H12N2O5
- Average molar mass
- 204.18 g/mol
- Monoisotopic mass
- 204.07462149
Names & identifiers
- Preferred name
- Ethyl N-2-acetoxyethylnitrosocarbamate
- IUPAC
- 2-[ethoxycarbonyl(nitroso)amino]ethyl acetate
- English name
- N-(2-Acetoxyethyl)-N-nitrosocarbamic acid ethyl ester
- Molecular formula
- C7H12N2O5
- Molecular weight
- 204.18
Names & synonyms
Ethyl N-2-acetoxyethylnitrosocarbamate62681-13-4N-(2-Acetoxyethyl)-N-nitrosocarbamic acid ethyl esterCarbamic acid, (2-(acetyloxy)ethyl)nitroso-, ethyl esterCarbamic acid, [2-(acetyloxy)ethyl]nitroso-, ethyl esterEthyl N-(2-acetoxyethyl)-N-nitrosocarbamate2-[ethoxycarbonyl(nitroso)amino]ethyl acetateN-(2-Hydroxyethyl)-N-nitrosocarbamic acid ethyl ester acetate8U3EA24WRM2-[(ETHOXYCARBONYL)(NITROSO)AMINO]ETHYL ACETATEDTXSID80211738Carbamic acid, (2-(acetyloxy)ethyl)nitroso-, ethyl ester (9CI)
Show more names
N-Acetoxyethyl-N-nitrosourethane2-Acetoxyethylnitrosocarbamic acid ethyl esterN-(2-Acetoxyethyl)-N-nitrosocarbamic acid ethylCarbamic acid, [2-(acetyloxy)ethyl]nitroso-, ethyl ester (9CI)
Ethyl 2-acetoxyethylnitrosocarbamateCARBAMIC ACID, N-(2-HYDROXYETHYL)-N-NITROSO-, ETHYL ESTER, ACETATEDB-371029
Database identifiers
- CAS
62681-13-4- PubChem CID
- 44138
- DTXSID
DTXSID80211738- UNII
- 8U3EA24WRM
- Nikkaji
- J3.523H
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Boiling point
- 342.66 °C · 342.66°C (rough estimate)
- Density
- 1.4123 · 1.4123 (rough estimate)
- refractive index
- 1.488 · 1.4880 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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