chempirical

1-Methyl-2-quinolone

C10H9NOCAS 606-43-9159.19 g/mol

Open in Covalent MOL file
NO

Properties

Molecular formula
C10H9NO
Molar mass
159.19 g/mol
Exact mass
159.0684 Da
Melting point
74 °C
Boiling point
325 °C
logP
1.54Crippen estimate
Polar surface area
22.0 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
606-43-9
SMILES
Cn1c(=O)ccc2ccccc21
InChIKey
QYEMNJMSULGQRD-UHFFFAOYSA-N
InChI
InChI=1S/C10H9NO/c1-11-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3

Weigh it out

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Names and synonyms

9 names
  • 1-Methyl-2(1H)-quinolinone
  • 2(1H)-Quinolinone, 1-methyl-
  • Carbostyril, 1-methyl-
  • N-Methylcarbostyril
  • 1-Methyl-2(1H)-quinolone
  • 1-Methylcarbostyril
  • N-Methyl-2-quinolone
  • 1-Methyl-1,2-dihydroquinolin-2-one
  • NSC 5873

Work with 1-Methyl-2-quinolone

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-Hydroxy-1-methyl-2(1H)-quinolinone1677-46-947 % similar 1,2-Dimethylindole875-79-647 % similar 1-Methyl-2-phenylindole3558-24-544 % similar N-Methylacridone719-54-044 % similar 1-Methyl-1H-indole-2-carboxylic acid16136-58-643 % similar 1-Methylindole603-76-942 % similar N-Methylcarbazole1484-12-441 % similar 3-Methylbenzo[d]oxazol-2(3H)-one21892-80-840 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

6-Quinolinemethanol100516-88-9 8-Amino-2-naphthol118-46-7 2-Quinolinemethanol1780-17-2 3-Methylquinoline N-oxide1873-55-8 1-Methylindole-3-carboxaldehyde19012-03-4 Indole-3-acetaldehyde2591-98-2 1-Isoquinolinemethanol27311-63-3 1-Amino-2-naphthol2834-92-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook