2-Cyclopentyloxypyridine-5-carboxaldehyde
Basic information
- CAS
916792-14-8- Standard SMILES
O=Cc1ccc(OC2CCCC2)nc1- InChIKey
NQJPWJIUEZZENP-UHFFFAOYSA-N- Molecular formula
- C11H13NO2
- Average molar mass
- 191.23 g/mol
- Monoisotopic mass
- 191.09462866
Names & identifiers
- Preferred name
- 2-Cyclopentyloxypyridine-5-carboxaldehyde
- IUPAC
- 6-cyclopentyloxypyridine-3-carbaldehyde
- English name
- 6-Cyclopentyloxypyridine-3-carboxaldehyde
- Molecular formula
- C11H13NO2
- Molecular weight
- 191.23
Names & synonyms
916792-14-82-Cyclopentyloxypyridine-5-carboxaldehyde6-(CYCLOPENTYLOXY)NICOTINALDEHYDE6-cyclopentyloxypyridine-3-carbaldehydeMFCD080609436-(Cyclopentyloxy)pyridine-3-carbaldehyde6-CYCLOPENTYLOXYPYRIDINE-3-CARBOXALDEHYDESCHEMBL2893597DTXSID50654799NQJPWJIUEZZENP-UHFFFAOYSA-NAKOS0062216106-(cyclopentoxy)pyridine-3-carbaldehyde
Show more names
3-Pyridinecarboxaldehyde, 6-(cyclopentyloxy)-2-Cyclopentyloxypyridine-5-carboxaldehyde, 98%
AS-40644DB-118546CS-0330328ST50825321
Database identifiers
- CAS
916792-14-8- PubChem CID
- 42553151
- DTXSID
DTXSID50654799
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 39.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Boiling point
- 325.1 · 325.1±22.0 °C(Predicted)
- Density
- 1.172 · 1.172±0.06 g/cm3(Predicted)
- pka
- 2.2 · 2.20±0.22(Predicted)
- Sensitive
- Air Sensitive
- Symbol(GHS)
- 7 · GHS07
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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