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4-Methylphenylacetic acid

Catalog No: FT-0659916

CAS No: 622-47-9

Chemical Name: 4-Methylphenylacetic acid
Molecular Formula: C9H10O2
Molecular Weight: 150.17
InChI Key: GXXXUZIRGXYDFP-UHFFFAOYSA-N
InChI: InChI=1S/C9H10O2/c1-7-2-4-8(5-3-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)

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

Symbol:	Warning
FW:	150.174
Density:	1.1±0.1 g/cm3
CAS:	622-47-9
Bolling_Point:	266.0±0.0 °C at 760 mmHg
Product_Name:	Tolylacetic acid
Melting_Point:	88-92 °C(lit.)
Flash_Point:	173.5±13.9 °C
MF:	C9H10O2

Molecular_Structure:	['1 . Molar refractive index 4219 ', '2 . Molar volume 1331 ', '3 . Parachor （902K）3433 ', '4 . Surface tension 441 ', '5 . Polarizability 1672']
Flash_Point:	173.5±13.9 °C
Refractive_Index:	1.546
FW:	150.174
Density:	1.1±0.1 g/cm3
Bolling_Point:	266.0±0.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :135 ', '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']
LogP:	1.97
Melting_Point:	88-92 °C(lit.)
PSA:	37.30000
MF:	C9H10O2
More_Info:	['1 . Appearance White 块状晶体。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）90-93 ', '5 . Boiling point（ºC,Atmospheric pressure）265-267 ', '6 . Boiling point（ºC,52kPa）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,60ºC）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。']
Vapor_Pressure:	0.0±0.5 mmHg at 25°C
Exact_Mass:	150.068085

Hazard_Codes:	Xi: Irritant;
Symbol:	Warning
Warning_Statement:	P261-P305 + P351 + P338
HS_Code:	29163900
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RTECS:	AJ7569000
Risk_Statements(EU):	R36/37/38
Safety_Statements:	S26-S36-S24/25
RIDADR:	NONH for all modes of transport
WGK_Germany:	3