[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone


Catalog No:   FT-0772978

CAS No:   102069-83-0

  • Chemical Name:  [(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
  • Molecular Formula:  C13H17NO3
  • Molecular Weight:  235.28
  • InChI Key:  ZPRSXRGRMZPZQY-JTQLQIEISA-N
  • InChI:  InChI=1S/C13H17NO3/c1-17-12-7-3-2-6-11(12)13(16)14-8-4-5-10(14)9-15/h2-3,6-7,10,15H,4-5,8-9H2,1H3/t10-/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
CAS: 102069-83-0
MF: C13H17NO3
Density: 1.18g/cm3
Flash_Point: 210.9ºC
Melting_Point: 104-107ºC(lit.)
Product_Name: [(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-(2-methoxyphenyl)methanone
Symbol: GHS07
Bolling_Point: 425ºC at 760mmHg
FW: 235.27900
MF: C13H17NO3
Density: 1.18g/cm3
Computational_Chemistry: ['1. XlogP :12 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 498 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :269 ', '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']
More_Info: ['1 . Appearance Unknow ', '2 . Density(g/mL,25ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC)104-107 ', '6 . Boiling point(ºC,1mmHg)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(°F)Unknow ', '9 . Specific rotation(ºF)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)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']
Exact_Mass: 235.12100
Vapor_Pressure: 5.55E-08mmHg at 25°C
Flash_Point: 210.9ºC
PSA: 49.77000
Molecular_Structure: ['五分子性质数据 ', '1 . Molar refractive index 6456 ', '2 . Molar volume (m3/mol)1993 ', '3 . Parachor (902K)5196 ', '4 . Surface tension 461 ', '5 . Dielectric constant N/A ', '6 偶极距(10 -24cm 3)N/A ', '7 . Polarizability 2559']
LogP: 1.23000
Bolling_Point: 425ºC at 760mmHg
FW: 235.27900
Refractive_Index: 1.561
Melting_Point: 104-107ºC(lit.)
Personal_Protective_Equipment: dust mask type N95 (US);Eyeshields;Gloves
Symbol: GHS07
Safety_Statements: 26-37/39
Warning_Statement: P261-P305 + P351 + P338
Hazard_Codes: Xi: Irritant;
HS_Code: 2933990090
RIDADR: NONH for all modes of transport
Risk_Statements(EU): 36/37/38

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