Salicylaldehyde
Properties
- Molecular formula
- C7H6O2
- Molar mass
- 122.12 g/mol
- Exact mass
- 122.0368 Da
- Density
- 1.1674 g/mL (at 20 °C)
- Melting point
- −7 °C
- Boiling point
- 197 °C
- Flash point
- 78 °C (closed cup)
- Water solubility
- slightly soluble
- logP
- 1.20Crippen estimate
- Polar surface area
- 37.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H312 Harmful in contact with skin53.3% of notifiers
- H315 Causes skin irritation53.9% of notifiers
- H319 Causes serious eye irritation53.7% of notifiers
- H341 Suspected of causing genetic defects53.2% of notifiers
Aggregated from 3,872 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P317, P318, P321, P330, P332+P317, P337+P317, P362+P364, P405, P501
Identifiers
CAS number
90-02-8SMILES
O=Cc1ccccc1OInChIKey
SMQUZDBALVYZAC-UHFFFAOYSA-NInChI
InChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9HWeigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
15 names · show all
- Benzaldehyde, 2-hydroxy-
- 2-Hydroxybenzaldehyde
- Salicylal
- Salicylic aldehyde
- o-Formylphenol
- 2-Formylphenol
- o-Hydroxybenzaldehyde
- NSC 112278
- NSC 49178
- NSC 83559
- NSC 83560
- NSC 83561
- NSC 83562
- NSC 97202
- 2-Hydroxy-1-benzaldehyde
Safety data sheets
One stored sheet lists this compound in section 3, matched by the CAS number 90-02-8. Each row opens the sheet with its composition and PDF.
Work with Salicylaldehyde
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
2,3-Dihydroxybenzaldehyde24677-78-965 % similar
Phthalaldehyde643-79-862 % similar
4-Hydroxy-1-naphthaldehyde7770-45-859 % similar
2,6-Dihydroxybenzaldehyde387-46-258 % similar
2,4-Dihydroxybenzaldehyde95-01-256 % similar
(1,1'-Biphenyl)-2,2'-dicarboxaldehyde1210-05-554 % similar
2,5-Dihydroxy-1,4-benzenedicarboxaldehyde1951-36-654 % similar
Salicylaldazine959-36-454 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.