6-Ethoxy-2-methylquinoline

C12H13NOCAS 6628-28-0187.24 g/mol

Open in Covalent MOL file
ON
Ether

Properties

Molecular formula
C12H13NO
Molar mass
187.24 g/mol
Exact mass
187.0997 Da
Melting point
71 °C
Boiling point
173 °C (at 14 Torr)
logP
2.94Crippen estimate
Polar surface area
22.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 39 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
6628-28-0
SMILES
CCOc1ccc2nc(C)ccc2c1
InChIKey
VTGXHCUQALWXCR-UHFFFAOYSA-N
InChI
InChI=1S/C12H13NO/c1-3-14-11-6-7-12-10(8-11)5-4-9(2)13-12/h4-8H,3H2,1-2H3

Weigh it out

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

Names and synonyms

5 names
  • Quinoline, 6-ethoxy-2-methyl-
  • Quinaldine, 6-ethoxy-
  • 6-Ethoxyquinaldine
  • NSC 60562
  • 2-Methyl-6-ethoxyquinoline

Work with 6-Ethoxy-2-methylquinoline

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

6-Methoxy-2-methylquinoline1078-28-064 % similar Ethyl2-methylquinoline-6-carboxylate855763-77-855 % similar 2,6-Dimethylquinoline877-43-054 % similar 2-Ethoxynaphthalene93-18-553 % similar 6-Fluoro-2-methylquinoline1128-61-650 % similar 6-Hydroxy-2-methylquinoline613-21-850 % similar 6-Amino-2-methylquinoline65079-19-850 % similar 6-Bromo-2-methylquinoline877-42-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(Phenylamino)-2-cyclohexen-1-one24706-50-1 Benzyl(furan-2-ylmethyl)amine4439-53-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook