2,5-Dimethoxytoluene

C9H12O2CAS 24599-58-4152.19 g/mol

Open in Covalent MOL file
OO
Ether

Properties

Molecular formula
C9H12O2
Molar mass
152.19 g/mol
Exact mass
152.0837 Da
Melting point
40–40.5 °C
Boiling point
214–218 °C
logP
2.01Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 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
24599-58-4
SMILES
COc1ccc(OC)c(C)c1
InChIKey
IQISOVKPFBLQIQ-UHFFFAOYSA-N
InChI
InChI=1S/C9H12O2/c1-7-6-8(10-2)4-5-9(7)11-3/h4-6H,1-3H3

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Names and synonyms

9 names
  • Benzene, 1,4-dimethoxy-2-methyl-
  • Toluene, 2,5-dimethoxy-
  • 1,4-Dimethoxy-2-methylbenzene
  • Methylhydroquinone dimethyl ether
  • 2-Methylhydroquinone dimethyl ether
  • 2-Methyl-1,4-dimethoxybenzene
  • NSC 149950
  • 2-Methyl-1,4-bis(methyloxy)benzene
  • 1-Methyl-2,5-dimethoxybenzene

Work with 2,5-Dimethoxytoluene

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

3,4-Dimethylanisole4685-47-668 % similar 1,2,4-Trimethoxybenzene135-77-364 % similar 2,4-Dimethylanisole6738-23-463 % similar 4-Methoxy-2-methylaniline102-50-161 % similar 1-Chloro-4-methoxy-2-methylbenzene13334-71-961 % similar 4-Bromo-2-methylanisole14804-31-059 % similar 1-Fluoro-4-methoxy-2-methylbenzene2338-54-759 % similar 4-Bromo-3-methylanisole27060-75-959 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(4-Hydroxyphenyl)-1-propanol10210-17-0 Ketoisophorone1125-21-9 Benzaldehyde dimethyl acetal1125-88-8 2-(3-Methylphenoxy)ethanol13605-19-1 2-Phenyl-1,3-propanediol1570-95-2 (S)-1-(4-Methoxyphenyl)ethanol1572-97-0 Bicyclo[3.3.1]nonane-2,6-dione16473-11-3 (R)-(-)-2-Methoxy-2-phenylethanol17628-72-7

Elsewhere

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