Ethyl N-(aminocarbonyl)carbamate
Properties
- Molecular formula
- C4H8N2O3
- Molar mass
- 132.12 g/mol
- Exact mass
- 132.0535 Da
- Melting point
- 196.5 °C
- Boiling point
- 190–191 °C
- logP
- 0.43Crippen estimate
- Polar surface area
- 85.9 Ų
- H-bond donors / acceptors
- 3 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H319 Causes serious eye irritation100% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P264+P265, P280, P305+P351+P338, P337+P317
Identifiers
CAS number
626-36-8SMILES
CCOC(O)=NC(=N)OInChIKey
PIHPSKJRLDSJPX-UHFFFAOYSA-NInChI
InChI=1S/C4H8N2O3/c1-2-9-4(8)6-3(5)7/h2H2,1H3,(H3,5,6,7,8)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- Carbamic acid, N-(aminocarbonyl)-, ethyl ester
- Allophanic acid, ethyl ester
- Carbamic acid, (aminocarbonyl)-, ethyl ester
- Ethyl allophanate
- NSC 119864
- NSC 272
- Ethyl carbamoylcarbamate
Work with Ethyl N-(aminocarbonyl)carbamate
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1,2-Diethyl 1,2-hydrazinedicarboxylate4114-28-756 % similar
Ethyl N-methylcarbamate105-40-852 % similar
Hydroxyurethane589-41-352 % similar
Ethyl carbazate4114-31-250 % similar
Ethyl carbamate51-79-645 % similar
Thiophanate23564-06-945 % similar
Ethyl N-phenylcarbamate101-99-544 % similar
Acetylurea591-07-140 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds