4-Pyridinepropanol
Properties
- Molecular formula
- C8H11NO
- Molar mass
- 137.18 g/mol
- Exact mass
- 137.0841 Da
- Melting point
- 37 °C
- Boiling point
- 289 °C
- logP
- 1.01Crippen estimate
- Polar surface area
- 33.1 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 3
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.8% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
2629-72-3SMILES
OCCCc1ccncc1InChIKey
PZVZGDBCMQBRMA-UHFFFAOYSA-NInChI
InChI=1S/C8H11NO/c10-7-1-2-8-3-5-9-6-4-8/h3-6,10H,1-2,7H2Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 4-(3-Hydroxypropyl)pyridine
- 3-(4-Pyridyl)propanol
- 3-(γ-Pyridyl)propanol
- 3-(4-Pyridyl)-1-propanol
- 3-Pyridin-4-ylpropanol
- NSC 3720
- NSC 66565
- 3-Pyridin-4-ylpropan-1-ol
Work with 4-Pyridinepropanol
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
4-Pyridinebutanol5264-15-386 % similar
4-Pyridineethanol5344-27-473 % similar
1,3-Bis(4′-pyridyl)propane17252-51-667 % similar
Benzenepropanol122-97-461 % similar
3-Pyridinepropanol2859-67-861 % similar
4-(3-Phenylpropyl)pyridine2057-49-058 % similar
1,2-Bis(4-pyridyl)ethane4916-57-857 % similar
4-Pyridinemethanol586-95-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.