Diethylcarbamic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
24579-70-2- Standard SMILES
CCN(CC)C(=O)O- InChIKey
APRJFNLVTJWEPP-UHFFFAOYSA-N- Molecular formula
- C5H11NO2
- Average molar mass
- 117.15 g/mol
- Monoisotopic mass
- 117.07897859
Overview
Diethylcarbamic acid is an organooxygen compound. It is functionally related to a carbonic acid.
Names & identifiers
- Preferred name
- Diethylcarbamic acid
- IUPAC
- diethylcarbamic acid
- English name
- N,N-Diethylcarbamic acid
- Molecular formula
- C5H11NO2
- Molecular weight
- 117.15
Names & synonyms
diethylcarbamic acid24579-70-2DTXSID50396006RefChem:338133DTXCID10346865SCHEMBL42299SCHEMBL42300SCHEMBL5406160SCHEMBL8476170CHEBI:183300N,N-Diethylcarbamic acidCarbamic acid, N,N-diethyl-
Database identifiers
- CAS
24579-70-2- PubChem CID
- 3757587
- DTXSID
DTXSID50396006- ChEBI
CHEBI:183300- Nikkaji
- J88.282H
Properties
Computed structural propertiesFilling in
- XLogP
- 0.4
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 78.5
Physicochemical properties
- Melting point
- -15 °C · -15°C
- Boiling point
- 218.95 °C · 218.95°C (rough estimate)
- Density
- 0.9276 · 0.9276
- refractive index
- 1.4206 · 1.4206 (estimate)
- pka
- 6.31 · 6.31±0.41(Predicted)
Chemistry & industry
Additional notes
DefinitionChEBI: Diethylcarbamic acid is an organooxygen compound. It is functionally related to a carbonic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…