2-(Acetylamino)-3-phenyl-2-propenoic acid

Catalog No: FT-0621702

CAS No: 5469-45-4

Chemical Name: 2-(Acetylamino)-3-phenyl-2-propenoic acid
Molecular Formula: C11H11NO3
Molecular Weight: 205.21
InChI Key: XODAOBAZOQSFDS-YFHOEESVSA-N
InChI: InChI=1S/C11H11NO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-7H,1H3,(H,12,13)(H,14,15)/b10-7-

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:	205.210
Density:	1.3±0.1 g/cm3
CAS:	5469-45-4
Bolling_Point:	455.4±45.0 °C at 760 mmHg
Product_Name:	DL-N-Acetaminocinnamic Acid
Melting_Point:	188-190 °C(lit.)
Flash_Point:	229.2±28.7 °C
MF:	C11H11NO3

Molecular_Structure:	['1 . Molar refractive index 5643 ', '2 . Molar volume （m3/mol）1637 ', '3 . Parachor （902K）4408 ', '4 . Surface tension 524 ', '5 . Polarizability （10 -24cm 3）2237']
Flash_Point:	229.2±28.7 °C
Refractive_Index:	1.605
FW:	205.210
Density:	1.3±0.1 g/cm3
Bolling_Point:	455.4±45.0 °C at 760 mmHg
Computational_Chemistry:	['1 . XlogP 0 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 664 ', '7 . Heavy Atom Count 15 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 278 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 0 ', '13 . Defined Bond Stereocenter Count 1 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
LogP:	1.88
Melting_Point:	188-190 °C(lit.)
PSA:	66.40000
MF:	C11H11NO3
More_Info:	['1 . Appearance White 吸湿性晶体。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）195 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '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 Insoluble in Water ，Soluble in 醇。']
Vapor_Pressure:	0.0±1.2 mmHg at 25°C
Exact_Mass:	205.073898

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
Hazard_Codes:	Xi:Irritant;
Risk_Statements(EU):	R36/38
Safety_Statements:	S26-S36
Symbol:	Warning
Warning_Statement:	P305 + P351 + P338
RIDADR:	NONH for all modes of transport
HS_Code:	2924299090
WGK_Germany:	3