2,4,5-Trimethylbenzoic acid

Catalog No: FT-0632307

CAS No: 528-90-5

Chemical Name: 2,4,5-Trimethylbenzoic acid
Molecular Formula: C10H12O2
Molecular Weight: 164.2
InChI Key: QENJZWZWAWWESF-UHFFFAOYSA-N
InChI: InChI=1S/C10H12O2/c1-6-4-8(3)9(10(11)12)5-7(6)2/h4-5H,1-3H3,(H,11,12)

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	150-153 °C(lit.)
CAS:	528-90-5
MF:	C10H12O2
Flash_Point:	140.8±13.9 °C
Product_Name:	2,4,5-Trimethylbenzoic Acid
Density:	1.1±0.1 g/cm3
FW:	164.201
Bolling_Point:	303.7±11.0 °C at 760 mmHg

Refractive_Index:	1.545
Vapor_Pressure:	0.0±0.7 mmHg at 25°C
Flash_Point:	140.8±13.9 °C
LogP:	3.28
Bolling_Point:	303.7±11.0 °C at 760 mmHg
PSA:	37.30000
Molecular_Structure:	['1 . Molar refractive index 4765 ', '2 . Molar volume 1507 ', '3 . Parachor （902K）3823 ', '4 . Surface tension 413 ', '5 . Polarizability 1889']
Computational_Chemistry:	['1 . XlogP 25 ', '2 . Hydrogen Bond Donor Count 1 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 1 ', '5 . Isotope Atom Count ', '6 . TPSA 373 ', '7 . Heavy Atom Count 12 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 177 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
Melting_Point:	150-153 °C(lit.)
MF:	C10H12O2
Exact_Mass:	164.083725
FW:	164.201
Density:	1.1±0.1 g/cm3
More_Info:	['1 . Appearance White 晶体or 粉末 ', '2 晶相相标准. Combustion heat(焓)(kJ·mol-1)-515440 ', '3 晶相标准声称热(焓)( kJ·mol-1)-49568 ', '4 . Melting point（ºC）152 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,8kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,551ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']

RTECS:	DI0887000
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi
WGK_Germany:	3
Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter