6-Methoxy-4-methylcoumarin

C₁₁H₁₀O₃CAS 6295-35-8190.20 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₀O₃
Molar mass: 190.20 g/mol
Exact mass: 190.0630 Da
logP: 2.11Crippen estimate
Polar surface area: 39.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

6295-35-8

SMILES

CC1=CC(=O)OC2=C1C=C(C=C2)OC

InChIKey

KNGPIBWCWOQBEK-UHFFFAOYSA-N

InChI

InChI=1S/C11H10O3/c1-7-5-11(12)14-10-4-3-8(13-2)6-9(7)10/h3-6H,1-2H3

Weigh it out

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Work with 6-Methoxy-4-methylcoumarin

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

6,7-Dimethoxy-4-methyl-2H-1-benzopyran-2-one4281-40-763 % similar 6-Hydroxy-4-methylcoumarin2373-31-159 % similar 4-Methylcoumarin607-71-657 % similar Herniarin531-59-954 % similar 4-Methoxycourmarin20280-81-353 % similar 7-Ethoxy-4-methylcoumarin87-05-852 % similar 4-Bromomethyl-7-methoxycoumarin35231-44-851 % similar 4-Methylumbelliferyl acetate2747-05-950 % similar

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

Same formula

(2E)-4-(4-Methylphenyl)-4-oxobut-2-enoic acid20972-36-5 7-Methoxy-4-methylcoumarin2555-28-4 7-Ethoxycoumarin31005-02-4 Heliotropyl acetone3160-37-0 2-Benzofurancarboxylic acid ethyl ester3199-61-9 4-Ethoxycoumarin35817-27-7 1-(7-Methoxy-2-benzofuranyl)ethanone43071-52-9 Methyl 3-(4-formylphenyl)-2-propenoate7560-50-1

Elsewhere

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