Catalog No.:AA00DEQM

53949-53-4 | Benzeneacetic acid, 4-(1-hydroxy-2-methylpropyl)--alpha--methyl- (9CI)

Name: Name:Benzeneacetic acid, 4-(1-hydroxy-2-methylpropyl)--alpha--methyl- (9CI)
Brand: AABLOCKS
SKU: AA00DEQM
Availability: InStock
Rating: 90 (10 reviews)

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5mg

≥98%

in stock

$82.00 $57.00

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10mg

≥98%

in stock

$145.00 $101.00

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25mg

≥98%

in stock

$322.00 $225.00

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Technical Information
Properties
Literature
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Technical Information
Properties
Literature

Technical Information

Catalog Number:

AA00DEQM

Chemical Name:

Benzeneacetic acid, 4-(1-hydroxy-2-methylpropyl)--alpha--methyl- (9CI)

CAS Number:

53949-53-4

Molecular Formula:

C13H18O3

Molecular Weight:

222.2802

MDL Number:

MFCD08275586

SMILES:

CC(C(c1ccc(cc1)C(C(=O)O)C)O)C

Properties

Form:

Solid

MP:

>80°C

Storage:

Keep in dry area;Room Temperature;

Computed Properties

Complexity:

229

Covalently-Bonded Unit Count:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Rotatable Bond Count:

Undefined Atom Stereocenter Count:

XLogP3:

2.4

Literature

Title: Identification of degradation products of ibuprofen arising from oxidative and thermal treatments.

Journal: Journal of pharmaceutical and biomedical analysis 20021015

Title: Yujie He, et al. Metabolism of Ibuprofen by Phragmites australis: Uptake and Phytodegradation. Environ Sci Technol. 2017 Apr 18;51(8):4576-4584.

Title: Noreen Y, et al. Development of a radiochemical cyclooxygenase-1 and -2 in vitro assay for identification of natural products as inhibitors of prostaglandin biosynthesis. J Nat Prod. 1998 Jan;61(1):2-7.

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