Dimethyl 1-(2-chloroethyl)cyclohexane-1,3-dicarboxylate
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Basic information
- Standard SMILES
COC(=O)C1CCCC(CCCl)(C(=O)OC)C1- InChIKey
WUCSJOORHNTILS-UHFFFAOYSA-N- Molecular formula
- C12H19ClO4
- Average molar mass
- 262.73 g/mol
Names & identifiers
- Preferred name
- Dimethyl 1-(2-chloroethyl)cyclohexane-1,3-dicarboxylate
- IUPAC
- dimethyl 1-(2-chloroethyl)cyclohexane-1,3-dicarboxylate
Names & synonyms
106004-10-81,3-dimethyl 1-(2-chloroethyl)cyclohexane-1,3-dicarboxylateSCHEMBL2876322dimethyl 1-(2-chloroethyl)cyclohexane-1,3-dicarboxylateWUCSJOORHNTILS-UHFFFAOYSA-NDB-3602531-(2-chloro-ethyl)-cyclohexane-1,3-dicarboxylic acid dimethyl ester
Database identifiers
- PubChem CID
- 13633975
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 292
Related reactions
2 records
Compound notes
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