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4-(4-Acetoxyphenyl)-2-butanone

Catalog No: FT-0634909

CAS No: 3572-06-3

Chemical Name: 4-(4-Acetoxyphenyl)-2-butanone
Molecular Formula: C12H14O3
Molecular Weight: 206.24 g/mol
InChI Key: UMIKWXDGXDJQJK-UHFFFAOYSA-N
InChI: InChI=1S/C12H14O3/c1-9(13)3-4-11-5-7-12(8-6-11)15-10(2)14/h5-8H,3-4H2,1-2H3

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:	N/A
CAS:	3572-06-3
MF:	C12H14O3
Flash_Point:	134.1±23.2 °C
Product_Name:	Cuelure
Density:	1.1±0.1 g/cm3
FW:	206.238
Bolling_Point:	352.6±0.0 °C at 760 mmHg

Refractive_Index:	1.506
Vapor_Pressure:	0.0±0.7 mmHg at 25°C
Flash_Point:	134.1±23.2 °C
LogP:	1.01
Bolling_Point:	352.6±0.0 °C at 760 mmHg
PSA:	43.37000
Molecular_Structure:	['1 . Molar refractive index 5643 ', '2 . Molar volume （m3/mol）1900 ', '3 . Parachor （902K）4700 ', '4 . Surface tension 374 ', '5 . Polarizability （10 -24cm 3）2237']
Computational_Chemistry:	['1 疏水参数计算参考值（XlogP3）17 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 5 ', '5 . Isotope Atom Count 3 ', '6 . TPSA 434 ', '7 . Heavy Atom Count 15 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 227 ', '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']
MF:	C12H14O3
Exact_Mass:	206.094299
FW:	206.238
Density:	1.1±0.1 g/cm3
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）1096 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）353 ', '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）4×10-5 ', '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 微Soluble in Water 的']

Risk_Statements(EU):	R36/37/38
WGK_Germany:	2
Personal_Protective_Equipment:	Eyeshields;Gloves
RTECS:	EL8950000
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi
HS_Code:	2915390090
Safety_Statements:	26-36