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Isobutyl anthranilate is an organic compound with a faint, orange flower-like odor. It is synthesized by heating the anhydride of N-carboxyl anthranilic acid with sodium isobutoxide and subsequently hydrolyzing the reaction product.

7779-77-3

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7779-77-3 Usage

Uses

Used in Flavor Industry:
Isobutyl anthranilate is used as a flavoring agent for its distinctive orange flower-like aroma. It is commonly employed in the creation of various food and beverage products to impart a pleasant and appealing taste.
Used in Perfumery Industry:
Isobutyl anthranilate is used as a fragrance ingredient in the perfumery industry. Its unique scent profile makes it a valuable component in the formulation of perfumes, colognes, and other scented products, adding depth and complexity to the overall fragrance.
Used in Aromatherapy Industry:
Isobutyl anthranilate is used in aromatherapy applications for its calming and uplifting properties. The pleasant aroma of isobutyl anthranilate can help to create a soothing and relaxing atmosphere, promoting mental well-being and stress relief.

Air & Water Reactions

Isobutyl anthranilate is sensitive to air and light. Insoluble in water.

Reactivity Profile

Isobutyl anthranilate hydrolyzes under acidic or basic conditions.

Health Hazard

ACUTE/CHRONIC HAZARDS: When heated to decomposition Isobutyl anthranilate emits toxic fumes.

Fire Hazard

Flash point data for Isobutyl anthranilate are not available. Isobutyl anthranilate is probably combustible.

Check Digit Verification of cas no

The CAS Registry Mumber 7779-77-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 7,7,7 and 9 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 7779-77:
(6*7)+(5*7)+(4*7)+(3*9)+(2*7)+(1*7)=153
153 % 10 = 3
So 7779-77-3 is a valid CAS Registry Number.
InChI:InChI=1/C11H15NO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7,12H2,1-2H3

7779-77-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name Isobutyl 2-aminobenzoate

1.2 Other means of identification

Product number -
Other names Benzoic acid, 2-amino-, 2-methylpropyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only. Food additives -> Flavoring Agents
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:7779-77-3 SDS

7779-77-3Relevant academic research and scientific papers

Synthesis, antimicrobial evaluation, ot-QSAR and mt-QSAR studies of 2-amino benzoic acid derivatives

Mahiwal, Kuldeep,Kumar, Pradeep,Narasimhan, Balasubramanian

experimental part, p. 293 - 307 (2012/09/07)

A series of 2-amino benzoic acid derivatives (1-28) were synthesized and evaluated for their in vitro antimicrobial activity against the panel of Gram positive, Gram negative bacterial and fungal strains. The results of antimicrobial studies indicated that, in general, the synthesized compounds were found to be bacteriostatic and fungistatic in action. QSAR studies performed by the development of one target and multi target models indicated that multi-target model was effective in describing the antimicrobial activity as well demonstrated the effect of structural parameters viz. LUMO, 3χv and W on antimicrobial activity of 2-amino benzoic acid derivatives. Springer Science+Business Media, LLC 2010.

Steric effects in acid-catalyzed decomposition and base-catalyzed cyclization of 1-(2-alkoxycarbonyl-phenyl)-3-phenyltriazenes

Pytela, Oldrich,Halama, Ales

, p. 751 - 763 (2007/10/03)

Eight derivatives of 1-(2-alkoxycarbonylphenyl)-3-phenyltriazene (R = methyl, ethyl, propyl, isopropyl, butyl, isobutyl, hexyl, and allyl) have been synthesized and their UV-VIS, IR, 1H and 13C NMR spectra measured. The NMR spectra have been interpreted in detail. The kinetics of acid-catalyzed decomposition and base-catalyzed cyclization of the title compounds have been measured in 52.1% w/w methanol at 25.0 °C. The unit reaction order has been verified and the cyclization product has been identified. The pH-profiles obtained have been used to calculate the catalytic rate constants kA (acid-catalyzed decomposition) and kB (base-catalyzed cyclization) of all the derivatives; the constants have been interpreted with regard to inductive and steric effects. The catalytic rate constant kA has been found to be independent of the substituents. The catalytic rate constant kB depends statistically significantly upon both inductive and steric effects, the sensitivity to the former being more significant. The experimental results and their interpretation confirm the base-catalyzed cyclization mechanism with formation of tetrahedral intermediate as the rate-limiting step.

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