CAS 480-63-7|2,4,6-Trimethylbenzoic acid

Introduction：Basic information about CAS 480-63-7|2,4,6-Trimethylbenzoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. Chemical & Physical Properties
3. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
4. Safety Information
5. Customs
6. Articles2
7. Synonyms

Common Name	2,4,6-Trimethylbenzoic acid
CAS Number	480-63-7	Molecular Weight	164.201
Density	1.1±0.1 g/cm3	Boiling Point	296.6±9.0 °C at 760 mmHg
Molecular Formula	C₁₀H₁₂O₂	Melting Point	152-155 °C(lit.)
MSDS	ChineseUSA	Flash Point	138.0±13.4 °C

Names

Name	2,4,6-trimethylbenzoic acid
Synonym	More Synonyms

Chemical & Physical Properties

Density	1.1±0.1 g/cm3
Boiling Point	296.6±9.0 °C at 760 mmHg
Melting Point	152-155 °C(lit.)
Molecular Formula	C₁₀H₁₂O₂
Molecular Weight	164.201
Flash Point	138.0±13.4 °C
Exact Mass	164.083725
PSA	37.30000
LogP	3.28
Vapour Pressure	0.0±0.7 mmHg at 25°C
Index of Refraction	1.545
InChIKey	FFFIRKXTFQCCKJ-UHFFFAOYSA-N
SMILES	Cc1cc(C)c(C(=O)O)c(C)c1

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DI0887010

CHEMICAL NAME :: Benzoic acid, 2,4,6-trimethyl-

CAS REGISTRY NUMBER :: 480-63-7

BEILSTEIN REFERENCE NO. :: 1866187

LAST UPDATED :: 199701

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C10-H12-O2

MOLECULAR WEIGHT :: 164.22

WISWESSER LINE NOTATION :: QVR B1 D1 F1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 562 mg/kg

TOXIC EFFECTS :: Behavioral - rigidity (including catalepsy) Behavioral - muscle contraction or spasticity

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1020,1968

Safety Information

Personal Protective Equipment	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
Hazard Codes	Xn
Risk Phrases	20/21/22
Safety Phrases	S22-S24/25
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	DI0887010
HS Code	29163900

Customs

HS Code	2916399090
Summary	2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

Articles2

[Kinetics of the interaction of a phosphorylating substrate analog with the Ca-ATPase of myosin and heavy meromyosin].

Nauchnye Doki. Vyss. Shkoly. Biol. Nauki (1) , 17-9, (1982)

Isolation of alpha-subunits of factor F1 from submitochondrial particles and the reconstitution of active ATPase from isolated alpha-subunits and beta-subunits bound to the mitochondrial membrane.

Biochem. J. 192(2) , 483-8, (1980)

The alpha-subunits of factor-F1 ATPase are removed by extraction of submitochondrial particles with 1.75 M-LiCl, with the consequent loss of ATPase activity. ATPase activity is reconstituted by incuba...

Synonyms

4-09-00-01854 (Beilstein Handbook Reference)

Benzoic acid,2,4,6-trimethyl

Benzoic acid, 2,4,6-trimethyl-

2,4,6-trimethylbenzoate

EINECS 207-553-9

QVR B1 D1 F1

MFCD00002481

Mesitylenecarboxylic acid

Mesitylene-2-carboxylic acid

2-Mesitylenecarboxylic acid

Mesitoic acid

4,4'-dimethoxybenzhydryl 2,4,6-trimethylbenzoate

2,4,6-Trimethylbenzoic acid

2,4,6-Trimethylbenzoicacid

2,4,6-Me3C6H2COOH

2,4,6-Me3C6H2CO2H

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