(2S)-2-[(2-benzamidoacetyl)amino]-3-phenylpropanoic acid

Catalog No: FT-0771694

CAS No: 744-59-2

Chemical Name: (2S)-2-[(2-benzamidoacetyl)amino]-3-phenylpropanoic acid
Molecular Formula: C18H18N2O4
Molecular Weight: 326.3
InChI Key: CCLJGZGVIQBNDH-HNNXBMFYSA-N
InChI: InChI=1S/C18H18N2O4/c21-16(12-19-17(22)14-9-5-2-6-10-14)20-15(18(23)24)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,19,22)(H,20,21)(H,23,24)/t15-/m0/s1

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

Bolling_Point:	673.3±55.0 °C at 760 mmHg
CAS:	744-59-2
MF:	C18H18N2O4
Density:	1.3±0.1 g/cm3
Melting_Point:	140-144ºC
Product_Name:	Hippuryl-Phe-OH
Flash_Point:	361.0±31.5 °C
FW:	326.346

MF:	C18H18N2O4
Density:	1.3±0.1 g/cm3
Computational_Chemistry:	['1 . XlogP 17 ', '2 . Hydrogen Bond Donor Count 3 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 7 ', '5 . Isotope Atom Count 4 ', '6 . TPSA 955 ', '7 . Heavy Atom Count 24 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 440 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 1 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）140-144 ', '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 Unknow']
Exact_Mass:	326.126648
Vapor_Pressure:	0.0±2.2 mmHg at 25°C
Flash_Point:	361.0±31.5 °C
PSA:	95.50000
Molecular_Structure:	['1 . Molar refractive index 8804 ', '2 . Molar volume （m3/mol）2574 ', '3 . Parachor （902K）7039 ', '4 . Surface tension 558 ', '5 . Dielectric constant ', '6 偶极距（10 -24cm 3） ', '7 . Polarizability 3490']
LogP:	2.18
Melting_Point:	140-144ºC
Bolling_Point:	673.3±55.0 °C at 760 mmHg
FW:	326.346
Refractive_Index:	1.600

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
HS_Code:	2924299090
RIDADR:	NONH for all modes of transport
Safety_Statements:	S22-S24/25