8-Hydroxyjulolidine-9-carboxaldehyde

C13H15NO2CAS 63149-33-7217.27 g/mol

Open in Covalent MOL file
OHON
AldehydePhenolTertiary amine

Properties

Molecular formula
C13H15NO2
Molar mass
217.27 g/mol
Exact mass
217.1103 Da
Melting point
70–72 °C
logP
1.90Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 44 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
63149-33-7
SMILES
O=Cc1cc2c3c(c1O)CCCN3CCC2
InChIKey
NRZXBDYODHLZBF-UHFFFAOYSA-N
InChI
InChI=1S/C13H15NO2/c15-8-10-7-9-3-1-5-14-6-2-4-11(12(9)14)13(10)16/h7-8,16H,1-6H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 1H,5H-Benzo[ij]quinolizine-9-carboxaldehyde, 2,3,6,7-tetrahydro-8-hydroxy-
  • 2,3,6,7-Tetrahydro-8-hydroxy-1H,5H-benzo[ij]quinolizine-9-carboxaldehyde
  • 9-Formyl-8-hydroxyjulolidine
  • 9-Formyl-8-julolidinol
  • 9-Formyl-8-hydroxy-2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizine

Work with 8-Hydroxyjulolidine-9-carboxaldehyde

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

8-Hydroxyjulolidine41175-50-246 % similar 2,3,6,7,10,11-Hexahydro-1H,5H-cyclopenta[3,4][1]benzopyrano[6,7,8-ij]quinolizin-12(9H)-one41175-45-541 % similar 9-Bromo-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinoline70173-54-539 % similar 2-Hydroxy-1,3,5-benzenetricarbaldehyde81502-74-138 % similar Coumarin 34355804-65-437 % similar Diformylcresol7310-95-437 % similar Coumarin 15353518-18-636 % similar Julolidine479-59-435 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl 4-(4-cyanophenyl)butanoate131379-33-4 N-Benzoyl-4-perhydroazepinone15923-40-7 7-Ethylamino-4,6-dimethylcoumarin26078-25-1 (-)-Securinine5610-40-2 Benzyl 5,6-dihydropyridine-1(2H)-carboxylate66207-23-6 Ethyl α-cyano-α-ethylbenzeneacetate718-71-8 4-(4-Oxocyclohexyl)benzamide73204-06-5 1-Boc-indole75400-67-8

Elsewhere

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