Basic information
- CAS
71923-01-8- Standard SMILES
Cl.Cl.O=c1oc(CCN2CCN(c3ccccc3)CC2)c(-c2ccc(Cl)cc2)o1- InChIKey
ZUCYXPFLHXXOFU-UHFFFAOYSA-N- Molecular formula
- C21H23Cl3N2O3
- Average molar mass
- 457.8 g/mol
- Monoisotopic mass
- 456.077426
Names & identifiers
- Preferred name
- 1,3-Dioxol-2-one, 4-(4-chlorophenyl)-5-(2-(4-phenyl-1-piperazinyl)ethyl)-, dihydrochloride
- IUPAC
- 4-(4-chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one;dihydrochloride
Names & synonyms
EINECS 276-183-84-(4-chlorophenyl)-5-[2-(4-phenyl-1-piperazinyl)ethyl]-1,3-dioxol-2-one dihydrochloride1,3-Dioxol-2-one, 4-(4-chlorophenyl)-5-(2-(4-phenyl-1-piperazinyl)ethyl)-, dihydrochlorideDTXSID802222034-(4-Chlorophenyl)-5-(2-(4-phenyl-1-piperazinyl)ethyl)-1,3-dioxol-2-one dihydrochlorideRefChem:218882DTXCID40144694276-183-871923-01-8SCHEMBL11473514ZUCYXPFLHXXOFU-UHFFFAOYSA-NNS00063171
Show more names
4-(4-Chlorophenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-2H-1,3-dioxol-2-one--hydrogen chloride (1/2)
Database identifiers
- CAS
71923-01-8- PubChem CID
- 51444
- DTXSID
DTXSID80222203- EC Number
- 276-183-8
Properties
Computed structural properties
- Topological polar surface area
- 42 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 546
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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