Basic information
- CAS
18719-42-1- Standard SMILES
CCOC(=O)C(CCCl)C(=O)OCC- InChIKey
ZBNRVCJGKAZEQW-UHFFFAOYSA-N- Molecular formula
- C9H15ClO4
- Average molar mass
- 222.66 g/mol
- Monoisotopic mass
- 222.0658866
Names & identifiers
- Preferred name
- Diethyl(2-chloroethyl)propanedioate
- IUPAC
- diethyl 2-(2-chloroethyl)propanedioate
- English name
- Diethyl 2-(2-chloroethyl)propanedioate
- Molecular formula
- C9H15ClO4
- Molecular weight
- 222.67
Names & synonyms
18719-42-1diethyl 2-(2-chloroethyl)propanedioatediethyl(2-chloroethyl)propanedioateDiethyl 2-(2-chloroethyl)malonateNSC107980Propanedioic acid, chloroethyl-, diethyl esterSCHEMBL9065703DTXSID20296145Diethyl (2-chloroethyl)propanedioateNSC-107980DS-000482CS-0166328
Show more names
Propanedioic acid, 2-(2-chloroethyl)-, 1,3-diethyl ester
diethyl 2-(2-chloroethyl)malonate? (Cabozantinib Impurity
Database identifiers
- CAS
18719-42-1- PubChem CID
- 267992
- DTXSID
DTXSID20296145
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 175
Chemistry & industry
Suppliers6 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
廊坊市恒福源医药科技有限公司0316-2883537 19333636468 · [email protected]
廊坊市泽康医药科技有限公司0316-2883536 19333636468 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
广州市震霖医药科技有限公司020-18102736 13622807357 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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