97888-80-7

97888-80-7 - Names and Identifiers

Name	4-Benzyloxy-3,5-dimethylbenzoic acid
Synonyms	RARECHEM AL BE 0474 4-Benzyloxy-3,5-Dimethylbenzoi 4-(benzyloxy)-3,5-dimethylbenzoate 3,5-DIMETHYL-4-BENZYLOXYBENZOICACID 4-BENZYLOXY-3,5-DIMETHYLBENZOIC ACID 4-Benzyloxy-3,5-dimethylbenzoic acid 3,5-dimethyl-4-phenylmethoxybenzoate 4-(Benzyloxy)-3,5-dimethylbenzoic acid Benzoic acid, 3,5-dimethyl-4-(phenylmethoxy)- benzoic acid, 3,5-dimethyl-4-(phenylmethoxy)-
CAS	97888-80-7
EINECS	925-930-2
InChI	InChI=1/C16H16O3/c1-11-8-14(16(17)18)9-12(2)15(11)19-10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H3,(H,17,18)/p-1

97888-80-7 - Physico-chemical Properties

Molecular Formula	C16H16O3
Molar Mass	256.3
Density	1.1320 (rough estimate)
Melting Point	159-162°C
Boling Point	359.54°C (rough estimate)
Flash Point	150.3°C
Vapor Presure	2.08E-07mmHg at 25°C
BRN	5045861
pKa	4.60±0.10(Predicted)
Storage Condition	2-8°C
Refractive Index	1.5590 (estimate)
MDL	MFCD00272572

97888-80-7 - Risk and Safety

Hazard Symbols	Xn - Harmful
Risk Codes	R36/37/38 - Irritating to eyes, respiratory system and skin. R22 - Harmful if swallowed
Safety Description	S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection.

97888-80-7 - Introduction

4-Benzyloxy-3,5-dimethylbenzoic acid, chemical formula C16H16O3, is an organic compound. The following is a description of its nature, use, preparation and safety information:

Nature:
-Appearance: 4-Benzyloxy-3,5-dimethylbenzoic acid is a white crystalline solid.
-Solubility: It has high solubility in non-polar solvents (such as chloroform, dichloromethane), but low solubility in polar solvents (such as water, ethanol).
-Melting point: about 110-112 ℃.
-Stability: It is relatively stable at room temperature, and storage under dark conditions can extend its life.

Use:
-Chemical synthesis intermediate: 4-Benzyloxy-3,5-dimethylbenzoic acid is often used as an intermediate in organic synthesis reactions to prepare other compounds.
-Pharmaceutical field: It plays an important role in the synthesis of certain drugs, such as for the preparation of specific classes of anticancer drugs.

Preparation Method:
The preparation of 4-Benzyloxy-3,5-dimethylbenzoic acid is usually carried out by the following method:
-It can be obtained by the Grignard reaction of 3,5-dimethylbenzaldehyde.
-It can also be obtained by benzylation of 3,5-dimethylbenzoic acid.

Safety Information:
- 4-Benzyloxy-3,5-dimethylbenzoic acid combustion produces toxic gases, should avoid human contact with its smoke or gas.
-When using or handling the compound, follow laboratory safety procedures and wear appropriate personal protective equipment, such as laboratory gloves and safety goggles.
-If ingested or inhaled, seek medical attention immediately.

Last Update：2024-04-09 02:00:49