Basic information
- CAS
4652-44-2- Standard SMILES
CCN(CC)C(=O)OC- InChIKey
VAGMFMWZIMXAGK-UHFFFAOYSA-N- Molecular formula
- C6H13NO2
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.09462866
Names & identifiers
- Preferred name
- Carbamic acid, diethyl-, methyl ester
- IUPAC
- methyl N,N-diethylcarbamate
- English name
- Diethylcarbamic acid methyl
- Molecular formula
- C6H13NO2
- Molecular weight
- 131.17
Names & synonyms
Methyl diethylcarbamate4652-44-2Carbamic acid, diethyl-, methyl esterDTXSID50196866RefChem:332347DTXCID90119357methyl N,N-diethylcarbamateMethyl diethylcarbamate #EUF4JG3XE4N,N-diethyl-o-methylcarbamateSCHEMBL514694SCHEMBL514695
Show more names
Diethylcarbamic acid methylDiethylcarbamic acid methyl ester
N-(Methoxycarbonyl)diethylamineN,N-Diethyl O-methyl carbamateSCHEMBL10606318VAGMFMWZIMXAGK-UHFFFAOYSA-NAKOS003856636Carbamic acid, N,N-diethyl-, methyl ester
Database identifiers
- CAS
4652-44-2- PubChem CID
- 78384
- DTXSID
DTXSID50196866- UNII
- EUF4JG3XE4
- Nikkaji
- J80.871G
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 89.1
Physicochemical properties
- Boiling point
- 154 · 154-155 °C
- Density
- 1 g/cm3 · 1.000 g/cm3
- pka
- -1.34 · -1.34±0.70(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers1 total
重庆天奕恒化科技有限公司15086758486; 15086758486 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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