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4'-(2-Methylpropyl)acetophenone

4'-(2-Methylpropyl)acetophenone Structure
CAS No.
38861-78-8
Chemical Name:
4'-(2-Methylpropyl)acetophenone
Synonyms
1-(4-ISOBUTYLPHENYL)ETHAN-1-ONE;4-ISOBUTYLACETOPHENONE;1-(4-ISOBUTYLPHENYL)ETHANONE;4-IBAP;Nsc173015;1Y1&1R DV1;Ibuprofen-4;IBUPROFEN IMP E;p-Isobutylacetoph;TIMTEC-BB SBB007668
CBNumber:
CB3210390
Molecular Formula:
C12H16O
Molecular Weight:
176.25
MOL File:
38861-78-8.mol
Modify Date:
2023/7/11 11:04:37

4'-(2-Methylpropyl)acetophenone Properties

Boiling point 134-135°C 16mm
Density 0,952 g/cm3
vapor pressure 0.75Pa at 20℃
refractive index 1.5180
Flash point 54°C
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility soluble in Dichloromethane; Diethyl Ether; Ethyl Acetate; THF
color Colorless to Yellow
Water Solubility Miscible with chloroform and methanol. Slightly miscible with water.
BRN 1935275
InChI InChI=1S/C12H16O/c1-9(2)8-11-4-6-12(7-5-11)10(3)13/h4-7,9H,8H2,1-3H3
InChIKey KEAGRYYGYWZVPC-UHFFFAOYSA-N
SMILES C(=O)(C1=CC=C(CC(C)C)C=C1)C
LogP 3.4 at 23℃
CAS DataBase Reference 38861-78-8(CAS DataBase Reference)
NIST Chemistry Reference 4'-(2-Methylpropyl)acetophenone(38861-78-8)
EPA Substance Registry System Ethanone, 1-[4-(2-methylpropyl)phenyl]- (38861-78-8)

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07,GHS09
Signal word  Warning
Hazard statements  H315-H317-H411
Precautionary statements  P261-P264-P272-P273-P280-P302+P352
Hazard Codes  Xn,N,Xi
Risk Statements  10-40-52/53-43
Safety Statements  16-36-22-61-36/37
RIDADR  1224
WGK Germany  3
TSCA  Yes
HazardClass  3.2
PackingGroup  III
HS Code  29143990
NFPA 704
2
2 0

4'-(2-Methylpropyl)acetophenone price More Price(4)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich(India) PHR1146 Ibuprofen Related Compound C Pharmaceutical Secondary Standard; Certified Reference Material 38861-78-8 500MG ₹10630.15 2022-06-14 Buy
TCI Chemicals (India) I0417 4'-Isobutylacetophenone min. 96.0 % 38861-78-8 25ML ₹4300 2022-05-26 Buy
TCI Chemicals (India) I0417 4'-Isobutylacetophenone min. 96.0 % 38861-78-8 100ML ₹12200 2022-05-26 Buy
TCI Chemicals (India) I0417 4'-Isobutylacetophenone min. 96.0 % 38861-78-8 500ML ₹36800 2022-05-26 Buy
Product number Packaging Price Buy
PHR1146 500MG ₹10630.15 Buy
I0417 25ML ₹4300 Buy
I0417 100ML ₹12200 Buy
I0417 500ML ₹36800 Buy

4'-(2-Methylpropyl)acetophenone Chemical Properties,Uses,Production

Chemical Properties

Clear Colourless Oil

Uses

A degradation product of Ibuprofen in tablets, which is a known toxin. Ibuprofen (I140000) impuritiy.

Preparation

Synthesis of 4-isobutylacetophenone: toluene and propylene are reacted with the participation of metal potassium, sodium carbonate and graphite, Alkylation on methyl to generate isobutylbenzene, Then with acetyl chloride in the participation of anhydrous aluminum trichloride to obtain the product.
Synthesis of 4-isobutylacetophenone

General Description

4'-(2-Methylpropyl)acetophenone, also known as Ibuprofen EP Impurity E, is an impurity of ibuprofen. Ibuprofen is a nonsteroidal anti-inflammatory drug (NSAID). It works by blocking your body's production of certain natural substances that cause inflammation.

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Imp. E:1-(4-isobutylphenyl)ethanone TIMTEC-BB SBB007668 P-ISO-BUTYLACETOPHENONE IBUPROFEN IMPURITY E IBUPROFEN IMP E ISOBUTYL ACETOPHENONE 4'-Isobutylacetophenone, 97+% 4'-ISOBUTYLACETOPHENONE 1-[4-(2-METHYLPROPYL)PHENYL]ETHANONE 1-[4-(2-methylpropyl)phenyl]-ethanon 4-Isobutylacetaphenone 1-[4-(2-methylpropyl)phenyl]ethan-1-one 1-(4-(2-METHYLPROPYL)PHENYL)ETNANONE 4'-(2-Methylpropyl)acetophenone 4-lsobutylacetophenone Acetophenone, 4-isobutyl- Ethanone, 1-[4-(2-methylpropyl)phenyl]- Nsc173015 p-Isobutylacetoph Ibuprofen IMpurity-E(EP) 4'-(2-Methylpropyl)a 1-[4-(2-Methylprop-1-yl)phenyl]ethan-1-one, 1-(4-Isobutylphenyl)ethan-1-one Ibuprofen Related CoMpound C, USP 3 ampules) (4-isobutylacetophenone) Ibuprofen Related Compound C (0.2 mL/ampule 1-[4-(2-Methylpropyl)phenyl]-1-ethanone 1-Acetyl-4-isobutylbenzene p-Acetylisobutylbenzene 4-ISOBUTYLACETOPHENONE(Ibuprofen Related Compound C)(Ibuprofen Impurity E) 1Y1&1R DV1 Ibuprofen-4 Ibuprofen EP Impurity E 4-IBAP Ibuprofen USP Related Compound C Ibuprofen EP Impurity E:Ibuprofen Impurity E 4'-Isobutylacetophenone> 4-Isobutylacetophenone(Ibuprofen Impurity) Ibuprofen Impurity 5(Ibuprofen EP Impurity E) Ibuprofen Impurity E/4-isobutylacetophenone Ibuprofen EP Impurity E/ Ibuprofen Related Compound C Ibuprofen USP Related Compound CQ: What is Ibuprofen USP Related Compound C Q: What is the CAS Number of Ibuprofen USP Related Compound C Q: What is the storage condition of Ibuprofen USP Related Compound C Q: What are the applications of Ibuprofen USP Related Compound C 4-ISOBUTYLACETOPHENONE 1-(4-ISOBUTYLPHENYL)ETHAN-1-ONE 1-(4-ISOBUTYLPHENYL)ETHANONE Ibuprofen EP Impurit 4'-Isobutylacetophenone, ≥ 96.0% 4’-Isobutylacetophenone 4'-(2-Methylpropyl)acetophenone 38861-78-8 Aromatic Acetophenones & Derivatives (substituted) Aromatics, Impurities, Pharmaceuticals, Intermediates & Fine Chemicals Aromatics Impurities Intermediates & Fine Chemicals Pharmaceuticals