Acetanisole - Materials / Alfa Chemistry

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Acetanisole

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Catalog Number

ACMA00017300

Product Name

Acetanisole

Category

Polymers

Description

Solid;colourless to pale yellow fused solid with a floral, powdery, vanillic, balsamic odour

IUPAC Name

1-(4-methoxyphenyl)ethanone

Molecular Weight

150.17g/mol

Molecular Formula

C9H10O2

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

258.0 °C;254 °C

Melting Point

38.5 °C;Mp 38-39 °;38.2 °C;38-39°C

Flash Point

138 °C (280 °F) - open cup

Density

1.0818 g/cu cm at 41 °C

Solubility

In water, 3.62X10+3 mg/L at 25 °C (est);Soluble in ethanol, diethyl ether, acetone and chloroform;Soluble in alcohol, ether, fixed oils;Soluble in fixed oils, propylene glycol; miscible with glycerin;insoluble in water; soluble in organic solvents, oils;very soluble (in ethanol)

Color/Form

Crystalline solid;Colorless to pale-yellow fused solid;Yellowish-white crystals

Complexity

135

Covalently-Bonded Unit Count

EC Number

202-815-9;922-271-2

Exact Mass

150.06808g/mol

Formal Charge

Heavy Atom Count

Log P

1.74 (LogP);1.74;log Kow = 1.74;1.74

MeSH Entry Terms

4-acetylanisole;4-methoxyacetophenone

Monoisotopic Mass

150.06808g/mol

NSC Number

209523;5601

Odor

Pleasant odor;Hawthorn odor;Similar to that of p-methylacetopheneone, suggestive of hawthorn and floral note of heliotrope

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)

Refractive Index

Index of refraction = 1.547 at 41 °C

Rotatable Bond Count

Stability

Stable under recommended storage conditions.

UNII

0IRH2BR587

Vapor Pressure

0.01 mmHg;6.44X10-3 mm Hg at 25 °C

XLogP3

1.7

MSDS

Download MSDS

COA

Download COA

Spec Sheet

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