Butyl methacrylate
Properties
- Molecular formula
- C8H14O2
- Molar mass
- 142.20 g/mol
- Exact mass
- 142.0994 Da
- Density
- 0.8936 g/mL (at 20 °C)
- Melting point
- −25 °C
- Boiling point
- 160 °C
- Flash point
- 50 °C (closed cup)
- Water solubility
- 800 mg/L (25 °C)
- logP
- 1.91Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 4
Hazards
Warning
- H226 Flammable liquid and vaporFlammable liquids
- H315 Causes skin irritationSkin corrosion/irritation
- H317 May cause an allergic skin reactionSensitization, Skin
- H319 Causes serious eye irritationSerious eye damage/eye irritation
- H335 May cause respiratory irritationSpecific target organ toxicity, single exposure; Respiratory tract irritation
Harmonised EU classification (CLP Annex VI, index 607-033-00-5), via PubChem.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P272, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
97-88-1SMILES
C=C(C)C(=O)OCCCCInChIKey
SOGAXMICEFXMKE-UHFFFAOYSA-NInChI
InChI=1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3Characterization data
Calculated from the structure, in the form journals print them.
¹H NMR
Predicted ¹H NMR (400 MHz, CDCl₃) δ 6.15 (d, J = 1.4 Hz, 1H), 5.58 (d, J = 1.4 Hz, 1H), 4.08 (t, J = 7.0 Hz, 2H), 1.71 (s, 3H), 1.67 (quint, J = 7.0 Hz, 2H), 1.27 (sext, J = 7.0 Hz, 2H), 0.86 (t, J = 7.0 Hz, 3H).¹³C NMR
Predicted ¹³C NMR (101 MHz, CDCl₃) δ 166.6, 137.7, 125.4, 68.1, 32.2, 19.3, 17.2, 13.7.[M + H]+
[M + H]+ Calcd for C8H15O2 143.1067[M + Na]+
[M + Na]+ Calcd for C8H14NaO2 165.0886[M − H]−
[M − H]− Calcd for C8H13O2 141.0921Elemental analysis
Anal. Calcd for C8H14O2: C, 67.57; H, 9.92.Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
14 names · show all
- 2-Propenoic acid, 2-methyl-, butyl ester
- Methacrylic acid, butyl ester
- n-Butyl methacrylate
- Butyl 2-methyl-2-propenoate
- Acryester B
- Blemmer BMA
- Butyl 2-methylacrylate
- NSC 20956
- 2-Methyl-2-propenoic acid butyl ester
- N 212
- Light ester NB
- Acryester BMA
- Visiomer n-BMA
- 2-Methyl-acrylic acid butyl ester
Work with Butyl methacrylate
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
Hexyl methacrylate142-09-689 % similar
Lauryl methacrylate142-90-589 % similar
Tridecyl methacrylate2495-25-289 % similar
Stearyl methacrylate32360-05-789 % similar
2-Butoxyethyl methacrylate13532-94-081 % similar
Propyl methacrylate2210-28-879 % similar
Butanediol dimethacrylate2082-81-778 % similar
Hexamethylene dimethacrylate6606-59-378 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.