(2S,3S)-TRANS-3-METHYLOXIRANE-2-METHYL 4-NITROBENZOATE


Catalog No:   FT-0642614

CAS No:   106268-97-7

  • Chemical Name:  (2S,3S)-TRANS-3-METHYLOXIRANE-2-METHYL 4-NITROBENZOATE
  • Molecular Formula:  C11H11NO5
  • Molecular Weight:  237.21
  • InChI Key:  BPOPJHHLTDEVBN-XVKPBYJWSA-N
  • InChI:  InChI=1S/C11H11NO5/c1-7-10(17-7)6-16-11(13)8-2-4-9(5-3-8)12(14)15/h2-5,7,10H,6H2,1H3/t7-,10-/m0/s1

Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Melting_Point: 103-105ºC
CAS: 106268-97-7
MF: C11H11NO5
Flash_Point: 178.3ºC
Product_Name: [(2S,3S)-3-methyloxiran-2-yl]methyl 4-nitrobenzoate
Density: 1.321g/cm3
FW: 237.20900
Bolling_Point: 382.6ºC at 760mmHg
Refractive_Index: 1.561
Vapor_Pressure: 4.69E-06mmHg at 25°C
Flash_Point: 178.3ºC
LogP: 2.06210
Bolling_Point: 382.6ºC at 760mmHg
PSA: 84.65000
Molecular_Structure: ['五分子性质数据 ', '1 . Molar refractive index 5812 ', '2 . Molar volume (m3/mol)1794 ', '3 . Parachor (902K)4840 ', '4 . Surface tension 529 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 2304']
Computational_Chemistry: ['1 . XlogP 17 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 5 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count ', '6 . TPSA 82 ', '7 . Heavy Atom Count 17 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 306 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 2 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
Melting_Point: 103-105ºC
MF: C11H11NO5
Exact_Mass: 237.06400
FW: 237.20900
Density: 1.321g/cm3
More_Info: ['1 . Appearance 粉末 ', '2 . Density(g/mL,25ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)103-105 ', '5 . Boiling point(ºC)Unknow ', '6 . Boiling point(ºC,50mmHg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(°C)Unknow ', '9 . Specific rotation(ºF)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,110ºC)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']
Hazard_Codes: Xi: Irritant;
HS_Code: 2916399090
Risk_Statements(EU): 36/37/38

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