Basic information
- CAS
91912-36-6- Standard SMILES
CN1C(CCl)CCC1CCl.Cl- InChIKey
CSXVRNOQBUCLJC-UHFFFAOYSA-N- Molecular formula
- C7H14Cl3N
- Average molar mass
- 218.5 g/mol
- Monoisotopic mass
- 217.019183
Names & identifiers
- Preferred name
- Erl 492
- IUPAC
- 2,5-bis(chloromethyl)-1-methylpyrrolidine;hydrochloride
Names & synonyms
91912-36-6ERL 492RefChem:1084228ERL-4922,5-Bis(chloromethyl)-1-methylpyrrolidine hydrochloridePyrrolidine, 2,5-bis(chloromethyl)-1-methyl-, hydrochlorideDTXSID509194562,5-Bis(chloromethyl)-1-methylpyrrolidine--hydrogen chloride (1/1)
Database identifiers
- CAS
91912-36-6- PubChem CID
- 3045349
- DTXSID
DTXSID50919456
Properties
Computed structural properties
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 95.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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