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Basic information
- CAS
7251-06-1- Standard SMILES
CCOC(=O)N1CCN(CCCCl)CC1- InChIKey
FPGYTTSMRFMJOF-UHFFFAOYSA-N- Molecular formula
- C10H19ClN2O2
- Average molar mass
- 234.72 g/mol
- Monoisotopic mass
- 234.1135055
Names & identifiers
- Preferred name
- Ethyl 4-(3-chloropropyl)piperazine-1-carboxylate
- IUPAC
- ethyl 4-(3-chloropropyl)piperazine-1-carboxylate
Names & synonyms
ethyl 4-(3-chloropropyl)piperazine-1-carboxylate74571-66-77251-06-14-(3-Chloro-Propyl)-piperazine-1-carboxylic acid ethyl esterSCHEMBL3270714DTXSID80328471FPGYTTSMRFMJOF-UHFFFAOYSA-NAKOS015941372
Database identifiers
- CAS
7251-06-1- PubChem CID
- 410641
- DTXSID
DTXSID80328471
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 194
Related reactions
4 records
Compound notes
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