Methyl carbamate
Properties
- Molecular formula
- C2H5NO2
- Molar mass
- 75.07 g/mol
- Exact mass
- 75.0320 Da
- Density
- 1.1361 g/mL (at 56 °C)
- Melting point
- 52–54 °C
- Boiling point
- 177 °C
- Water solubility
- ≥ 100 g/L (18.9 °C)
- logP
- 0.13Crippen estimate
- Polar surface area
- 53.3 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation65.4% of notifiers
- H319 Causes serious eye irritation99.2% of notifiers
- H335 May cause respiratory irritation65.3% of notifiers
- H351 Suspected of causing cancer99.6% of notifiers
Aggregated from 758 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
598-55-0SMILES
COC(=N)OInChIKey
GTCAXTIRRLKXRU-UHFFFAOYSA-NInChI
InChI=1S/C2H5NO2/c1-5-2(3)4/h1H3,(H2,3,4)Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Carbamic acid, methyl ester
- Methylurethane
- Urethylane
- NSC 3054
Reactions
Work with Methyl 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
1,1-Dimethylethyl carbamate4248-19-543 % similar
Ethyl carbamate51-79-643 % similar
Butyl carbamate592-35-837 % similar
2-Chloroethyl carbamate2114-18-335 % similar
Methyl acetimidate hydrochloride14777-27-633 % similar
Methyl trichloroacetimidate2533-69-933 % similar
Phenyl carbamate622-46-833 % similar
O-Methylisourea hydrochloride5329-33-932 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds