Basic information
- CAS
6306-68-9- Standard SMILES
CCCCCOC(=O)n1cccc1- InChIKey
JQFDOBLEABQBFI-UHFFFAOYSA-N- Molecular formula
- C10H15NO2
- Average molar mass
- 181.23 g/mol
- Monoisotopic mass
- 181.11027872
Names & identifiers
- Preferred name
- Pentyl pyrrole-1-carboxylate
- IUPAC
- pentyl pyrrole-1-carboxylate
- English name
- pentyl pyrrole-1-carboxylate
- Molecular formula
- C10H15NO2
- Molecular weight
- 181.23
Names & synonyms
6306-68-9pentyl pyrrole-1-carboxylatepentyl 1h-pyrrole-1-carboxylateNSC42041SCHEMBL28810272DTXSID30285484NSC-420411H-Pyrrole-1-carboxylic acid, pentyl ester
Database identifiers
- CAS
6306-68-9- PubChem CID
- 237948
- DTXSID
DTXSID30285484
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 153
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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