Methyl quinoline-6-carboxylate
Properties
- Molecular formula
- C11H9NO2
- Molar mass
- 187.20 g/mol
- Exact mass
- 187.0633 Da
- Melting point
- 85–86 °C
- logP
- 2.02Crippen estimate
- Polar surface area
- 39.2 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the 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
38896-30-9SMILES
COC(=O)c1ccc2ncccc2c1InChIKey
XSRWQTDEIOHXSL-UHFFFAOYSA-NInChI
InChI=1S/C11H9NO2/c1-14-11(13)9-4-5-10-8(7-9)3-2-6-12-10/h2-7H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
3 names
- Methyl 6-quinolinecarboxylate
- 6-Quinolinecarboxylic acid, methyl ester
- 6-Carbomethoxyquinoline
Work with Methyl quinoline-6-carboxylate
Similar compounds
Methyl 2-naphthoate2459-25-862 % similar
2,6-Dimethyl 2,6-naphthalenedicarboxylate840-65-360 % similar
6-Quinolinecarboxylic acid10349-57-257 % similar
Methyl 6-quinolineacetate5622-36-657 % similar
Methyl 1,2,3-benzotriazole-5-carboxylate113053-50-254 % similar
Methyl 2,1,3-benzothiadiazole-5-carboxylate175204-21-454 % similar
Methyl 2-chloroisonicotinate58481-11-154 % similar
Methyl 1H-1,3-benzodiazole-5-carboxylate26663-77-453 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds