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N-(4-Aminobenzoyl)-beta-alanine

Catalog No: FT-0636462

CAS No: 7377-08-4

Chemical Name: N-(4-Aminobenzoyl)-beta-alanine
Molecular Formula: C10H12N2O3
Molecular Weight: 208.21
InChI Key: VHAXWROFYVPXMZ-UHFFFAOYSA-N
InChI: InChI=1S/C10H12N2O3/c11-8-3-1-7(2-4-8)10(15)12-6-5-9(13)14/h1-4H,5-6,11H2,(H,12,15)(H,13,14)

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

FW:	208.214
CAS:	7377-08-4
Melting_Point:	152-154 °C(lit.)
Bolling_Point:	519.4±35.0 °C at 760 mmHg
MF:	C10H12N2O3
Product_Name:	N-(4-Aminobenzoyl)-β-alanine
Flash_Point:	267.9±25.9 °C
Density:	1.3±0.1 g/cm3

FW:	208.214
MF:	C10H12N2O3
Refractive_Index:	1.604
Vapor_Pressure:	0.0±1.4 mmHg at 25°C
Bolling_Point:	519.4±35.0 °C at 760 mmHg
Exact_Mass:	208.084793
PSA:	92.42000
Computational_Chemistry:	['1 . XlogP 03 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 3 ', '5 . TPSA 953 ', '6 . Heavy Atom Count 15 ', '7 . Topological Polar Surface Area -1 ', '8 . Complexity 229 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
Molecular_Structure:	['1 . Molar refractive index 5494 ', '2 . Molar volume （m3/mol）1596 ', '3 . Parachor （902K）4476 ', '4 . Surface tension 617 ', '5 . Polarizability （10 -24cm 3）2178']
LogP:	-0.22
Melting_Point:	152-154 °C(lit.)
Flash_Point:	267.9±25.9 °C
Density:	1.3±0.1 g/cm3
More_Info:	['1 . Appearance 类White to Yellow 粉末 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）152-154 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index 无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']