Basic information
- CAS
872-81-1- Standard SMILES
CCCC1=NCCC1- InChIKey
BCGKMGNCBWZSPC-UHFFFAOYSA-N- Molecular formula
- C7H13N
- Average molar mass
- 111.18 g/mol
- Monoisotopic mass
- 111.10479942
Names & identifiers
- Preferred name
- 5-Propyl-3,4-dihydro-2H-pyrrole
- IUPAC
- 5-propyl-3,4-dihydro-2H-pyrrole
Names & synonyms
5-Propyl-3,4-dihydro-2H-pyrrole2-Propyl-1-pyrroline1-Pyrroline, 2-propyl-872-81-1SCHEMBL15919221DTXSID30236178MFCD28040031AKOS025213038
Database identifiers
- CAS
872-81-1- PubChem CID
- 565951
- DTXSID
DTXSID30236178- Nikkaji
- J2.105.903J
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 94.6
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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