Product Name
4'-Methoxyacetophenone
Category
Liquid Crystal (LC) Building Blocks
Description
Solid;colourless to pale yellow fused solid with a floral, powdery, vanillic, balsamic odour
IUPAC Name
1-(4-Methoxyphenyl)ethanone
Canonical SMILES
CC(=O)C1=CC=C(C=C1)OC
InChI
InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3
InChI Key
NTPLXRHDUXRPNE-UHFFFAOYSA-N
Boiling Point
152-154 °C/26 mmHg(lit.)
Melting Point
36-38 °C(lit.)
Solubility
Insoluble in water
Storage
Keep in dark place, sealed in dry, room temperature
Color/Form
Crystalline solid;Colorless to pale-yellow fused solid;Yellowish-white crystals
Covalently-Bonded Unit Count
1
EC Number
202-815-9;922-271-2
Hazard Statements
H302 : Harmful if swallowed.H315 : Causes skin irritation.
Log P
1.74 (LogP);1.74;log Kow = 1.74;1.74
MeSH Entry Terms
4-acetylanisole;4-methoxyacetophenone
Monoisotopic Mass
150.068079557
Odor
Floral, powdery, vanillic, balsamic odor
Other Experimental
Henry's Law constant = 8.88X10-6 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 2.05X10-11 cu cm/molec-sec at 25 °C (est)
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P270 : Do not eat, drink or smoke when using this product.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P301 + P312 + P330 : IF SWALLOWED: Call a POISON CENTER/doctor if you feel unwell. Rinse mouth.
Stability
Stable under recommended storage conditions.
Storage Conditions
Dark and dry place,Room Temperature
Topological Polar Surface Area
26.3 Ų
Vapor Pressure
0.01 mmHg;6.44X10-3 mm Hg at 25 °C