Basic information
- CAS
63884-60-6- Standard SMILES
CCOC(=O)NC(=O)C(CC)(CC)C(=O)NC(=O)OCC- InChIKey
GGRAYWKQKPBDHR-UHFFFAOYSA-N- Molecular formula
- C13H22N2O6
- Average molar mass
- 302.32 g/mol
- Monoisotopic mass
- 302.14778643
Names & identifiers
- Preferred name
- Carbamic acid, (2,2-diethylpropanedioyl)di-, diethyl ester
- IUPAC
- ethyl N-[2-(ethoxycarbonylcarbamoyl)-2-ethylbutanoyl]carbamate
- English name
- (2,2-Diethyl-1,3-dioxopropane-1,3-diyl)dicarbamic acid diethyl ester
- Molecular formula
- C13H22N2O6
- Molecular weight
- 302.32
Names & synonyms
MC 2659BRN 180620163884-60-6CARBAMIC ACID, (2,2-DIETHYLPROPANEDIOYL)DI-, DIETHYL ESTER(2,2-Diethylpropanedioyl)dicarbamic acid, diethyl esterMalonamide, N,N'-diethoxycarbonyl-2,2-diethyl-DTXSID302134090-03-00-00027 (Beilstein Handbook Reference)RefChem:331813DTXCID80135900(2,2-Diethyl-1,3-dioxopropane-1,3-diyl)dicarbamic acid diethyl esterDB-309687
Show more names
MC-2659Carbamic acid, (2,2-diethyl-1,3-dioxo-1,3-propanediyl)bis-, diethyl ester (9CI)
Ethyl {2-[(ethoxycarbonyl)carbamoyl]-2-ethylbutanoyl}carbamate
Database identifiers
- CAS
63884-60-6- PubChem CID
- 44941
- DTXSID
DTXSID30213409- Nikkaji
- J67.574A
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 369
Physicochemical properties
- Density
- 1.153 · 1.153±0.06 g/cm3(Predicted)
- pka
- 7.28 · 7.28±0.46(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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