(4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)propanoate

Catalog No: FT-0772053

CAS No: 1168-87-2

Chemical Name: (4-nitrophenyl) (2S)-2-(phenylmethoxycarbonylamino)propanoate
Molecular Formula: C17H16N2O6
Molecular Weight: 344.32
InChI Key: SXWWICLSRXPNNW-LBPRGKRZSA-N
InChI: InChI=1S/C17H16N2O6/c1-12(18-17(21)24-11-13-5-3-2-4-6-13)16(20)25-15-9-7-14(8-10-15)19(22)23/h2-10,12H,11H2,1H3,(H,18,21)/t12-/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

Base Information
Chemical Information

Melting_Point:	N/A
FW:	344.319
CAS:	1168-87-2
MF:	C17H16N2O6
Flash_Point:	282.0±28.7 °C
Product_Name:	Benzyloxycarbonyl-L-alaninep-nitrophenylester
Bolling_Point:	542.7±45.0 °C at 760 mmHg
Density:	1.3±0.1 g/cm3

Refractive_Index:	1.586
Vapor_Pressure:	0.0±1.4 mmHg at 25°C
Flash_Point:	282.0±28.7 °C
LogP:	3.49
Bolling_Point:	542.7±45.0 °C at 760 mmHg
FW:	344.319
PSA:	110.45000
Computational_Chemistry:	['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :6 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :2 ', '6. TPSA 110 ', '7. Heavy Atom Count :25 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :464 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :1 ', '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:	C17H16N2O6
Exact_Mass:	344.100830
Molecular_Structure:	['1 . Molar refractive index 8785 ', '2 . Molar volume 2618 ', '3 . Parachor （902K）7058 ', '4 . Surface tension 528 ', '5 . Polarizability 3482']
Density:	1.3±0.1 g/cm3