Basic information
- CAS
13149-70-7- Standard SMILES
CCOC(=O)C1CCC1C(=O)OCC- InChIKey
QAGGDTTXACRADK-UHFFFAOYSA-N- Molecular formula
- C10H16O4
- Average molar mass
- 200.23 g/mol
- Monoisotopic mass
- 200.10485899
Names & identifiers
- Preferred name
- Diethyl cyclobutane-1,2-dicarboxylate
- IUPAC
- diethyl cyclobutane-1,2-dicarboxylate
- English name
- 1,2-Cyclobutanedicarboxylic acid, 1,2-diethyl ester
- Molecular formula
- C10H16O4
- Molecular weight
- 200.23
Names & synonyms
diethyl cyclobutane-1,2-dicarboxylate13149-70-7SCHEMBL1246430DTXSID20927225diethyl 1,2-cyclobutanedicarboxylatediethylcyclobutane-1,2-dicarboxylateNSC118989NSC-118989G880651,2-Cyclobutanedicarboxylic acid, 1,2-diethyl ester
Database identifiers
- CAS
13149-70-7- PubChem CID
- 273617
- DTXSID
DTXSID20927225- Nikkaji
- J2.865.103A
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Boiling point
- 104 · 104-105 °C(Press: 14 Torr)
- Density
- 1.1189 g/cm3 · 1.1189 g/cm3(Temp: 418 °C)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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