Basic information
- CAS
6335-02-0- Standard SMILES
CCOC(=O)C(CCOC)C(=O)OCC- InChIKey
NBUBXXFBXDUOHG-UHFFFAOYSA-N- Molecular formula
- C10H18O5
- Average molar mass
- 218.25 g/mol
- Monoisotopic mass
- 218.11542367
Names & identifiers
- Preferred name
- Malonic acid, 2-methoxyethyl-, diethyl ester
- IUPAC
- diethyl 2-(2-methoxyethyl)propanedioate
- English name
- Propanedioic acid, 2-(2-methoxyethyl)-, 1,3-diethyl ester
- Molecular formula
- C10H18O5
- Molecular weight
- 218.25
Names & synonyms
6335-02-0Malonic acid, 2-methoxyethyl-, diethyl esterDTXSID40212741NSC 17327RefChem:351838DTXCID70135232Diethyl 2-(2-methoxyethyl)malonate1,3-diethyl 2-(2-methoxyethyl)propanedioatediethyl 2-(2-methoxyethyl)propanedioateDIETHYL (2-METHOXYETHYL)PROPANEDIOATEPropanedioic acid, (2-methoxyethyl)-, diethyl esterSCHEMBL1748128
Show more names
DIETHYL (2-METHOXYETHYL)-MALONATEPropanedioic acid, 2-(2-methoxyethyl)-, 1,3-diethyl ester
NSC17327MFCD00085739NSC-17327AKOS017547926SY567369DB-141641CS-0347792EN300-125187
Database identifiers
- CAS
6335-02-0- PubChem CID
- 22801
- DTXSID
DTXSID40212741- Nikkaji
- J1.560.948F
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 110 · 110-111 °C(Press: 6 Torr)
- Density
- 1.0397 g/cm3 · 1.0397 g/cm3
- pka
- 12.49 · 12.49±0.59(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
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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