138177
2,5-Dimethylbenzoic acid
95%
Synonym(s):
p-Xylylic acid
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About This Item
Linear Formula:
(CH3)2C6H3CO2H
CAS Number:
Molecular Weight:
150.17
Beilstein:
971588
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
95%
form
powder
bp
268 °C (lit.)
mp
132-134 °C (lit.)
SMILES string
Cc1ccc(C)c(c1)C(O)=O
InChI
1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChI key
XZRHNAFEYMSXRG-UHFFFAOYSA-N
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General description
2,5-Dimethylbenzoic acid is a metabolite of pseudocumene (1,2,4-trimethylbenzene).
Application
2,5-Dimethylbenzoic acid was used in the synthesis of new derivatives of [24]paracyclophane. It was used as starting reagent in the synthesis of methyl 2,5-dimethylbenzoate.
Signal Word
Warning
Hazard Statements
Precautionary Statements
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Substituted [24] paracyclophanes.
Shabtai E , et al.
Journal of the Chemical Society. Perkin Transactions 1, 2(11), 2411-2414 (1997)
Synthesis and properties of photoluminescent polymers bearing electron-facilitating oxadiazole derivative side groups.
Kim JJ, et al.
Journal of Polymer Science Part A: Polymer Chemistry, 40(8), 1173-1183 (2002)
Radosław Swiercz et al.
International journal of occupational medicine and environmental health, 15(1), 37-42 (2002-06-01)
The objective of this study was to evaluate the toxicokinetics and metabolism of pseudocumene after inhalation exposure. Male Wistar rats were exposed to pseudocumene vapors at nominal concentrations of 25,100 or 250 ppm in the dynamic inhalation chambers for 6
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