Home Sulfos 1-(4-fluorobenzenesulfonyl)-5-(hydroxymethyl)pyrrolidine-2-carboxylic acid, cis

1-(4-fluorobenzenesulfonyl)-5-(hydroxymethyl)pyrrolidine-2-carboxylic acid, cis

CAS No.:
1955473-91-2
Catalog Number:
AG01BC4W
Molecular Formula:
C12H14FNO5S
Molecular Weight:
303.3067
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BC4W
Chemical Name:
1-(4-fluorobenzenesulfonyl)-5-(hydroxymethyl)pyrrolidine-2-carboxylic acid, cis
CAS Number:
1955473-91-2
Molecular Formula:
C12H14FNO5S
Molecular Weight:
303.3067
MDL Number:
MFCD28714711
IUPAC Name:
(2S,5R)-1-(4-fluorophenyl)sulfonyl-5-(hydroxymethyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C12H14FNO5S/c13-8-1-4-10(5-2-8)20(18,19)14-9(7-15)3-6-11(14)12(16)17/h1-2,4-5,9,11,15H,3,6-7H2,(H,16,17)/t9-,11+/m1/s1
InChI Key:
PEALVXOURMTWLW-KOLCDFICSA-N
SMILES:
OC[C@H]1CC[C@H](N1S(=O)(=O)c1ccc(cc1)F)C(=O)O
Properties
Complexity:
455  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
303.058g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
303.304g/mol
Monoisotopic Mass:
303.058g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties