2-Methylphenyl acetate

C₉H₁₀O₂CAS 533-18-6150.18 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₀O₂
Molar mass: 150.18 g/mol
Exact mass: 150.0681 Da
Density: 1.0578 g/mL (at 20 °C)
Boiling point: 208 °C
logP: 1.92Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

533-18-6

SMILES

CC(=O)Oc1ccccc1C

InChIKey

AMZORBZSQRUXNC-UHFFFAOYSA-N

InChI

InChI=1S/C9H10O2/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3

Weigh it out

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

Names and synonyms

12 names

Acetic acid, 2-methylphenyl ester
Acetic acid, o-tolyl ester
Acetyl-o-cresol
o-Cresol acetate
o-Cresylic acetate
o-Tolyl acetate
o-Cresyl acetate
o-Methylphenyl acetate
o-Acetoxytoluene
2-Acetoxytoluene
NSC 58961
NSC 6257

Work with 2-Methylphenyl acetate

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

Acetpyrogall525-52-060 % similar 2-Chlorophenyl acetate4525-75-159 % similar Vitamin K4573-20-658 % similar 1-Naphthyl acetate830-81-958 % similar 2-(Acetyloxy)benzonitrile5715-02-656 % similar Aspirin50-78-254 % similar Acetylsalicyloyl chloride5538-51-254 % similar Phenyl acetate122-79-253 % similar

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

Same formula

Acetanisole100-06-1 4-Ethoxybenzaldehyde10031-82-0 Methyl phenylacetate101-41-7 (2,3-Dihydro-1-benzofuran-5-yl)methanol103262-35-7 2-Phenylethyl formate104-62-1 Hydroxychavicol1126-61-0 3-Methylphenyl acetate122-46-3 Phenyl glycidyl ether122-60-1

Elsewhere

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