6-Methoxy-1-tetralone

C₁₁H₁₂O₂CAS 1078-19-9176.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₂O₂
Molar mass: 176.21 g/mol
Exact mass: 176.0837 Da
Melting point: 78 °C
Boiling point: 135–139 °C (at 1 Torr)
logP: 2.21Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

1078-19-9

SMILES

COc1ccc2c(c1)CCCC2=O

InChIKey

MNALUTYMBUBKNX-UHFFFAOYSA-N

InChI

InChI=1S/C11H12O2/c1-13-9-5-6-10-8(7-9)3-2-4-11(10)12/h5-7H,2-4H2,1H3

Weigh it out

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

Names and synonyms

11 names

1(2H)-Naphthalenone, 3,4-dihydro-6-methoxy-
3,4-Dihydro-6-methoxy-1(2H)-naphthalenone
6-Methoxy-1-oxo-1,2,3,4-tetrahydronaphthalene
6-Methoxy-α-tetralone
1,2,3,4-Tetrahydro-6-methoxy-1-naphthalenone
1-Oxo-1,2,3,4-tetrahydro-6-methoxynaphthalene
6-Methoxy-3,4-dihydro-1(2H)-naphthalenone
NSC 41700
6-Methoxy-3,4-dihydro-2H-naphthalen-1-one
6-Methoxy-3,4-dihydronaphthalene-1(2H)-one
6-Methoxy-1,2,3,4-tetrahydronaphthalen-1-one

Work with 6-Methoxy-1-tetralone

Predict the NMR spectrum1H and 13C shifts with multiplicities Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

Ethyl cinnamate103-36-6 Cinnamyl acetate103-54-8 5,6,7,8-Tetrahydro-2-naphthoic acid1131-63-1 Allyl phenylacetate1797-74-6 2-Methyl-1-phenyl-3-butyne-1,2-diol2033-94-5 (+)-1,2,3,4-Tetrahydronaphthalene-1-carboxylic acid23357-47-3 6-Methoxy-2-tetralone2472-22-2 Benzyl methacrylate2495-37-6

Elsewhere

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