128899-31-0
(R)-(5-OXOPYRROLIDIN-2-YL)METHYL 4-METHYLBENZENESULFONATE
Name(R)-(5-OXOPYRROLIDIN-2-YL)METHYL 4-METHYLBENZENESULFONATE
1Identification
【Name】
(R)-(5-OXOPYRROLIDIN-2-YL)METHYL 4-METHYLBENZENESULFONATE
【CAS】
【MDL】
MFCD09864865
【English Synonyms】
【Formula】
C12 H15 N O4 S
【MolWeight】
269.319
【Inchi】
InChI=1S/C12H15NO4S/c1-9-2-5-11(6-3-9)18(15,16)17-8-10-4-7-12(14)13-10/h2-3,5-6,10H,4,7-8H2,1H3,(H,13,14)/t10-/m1/s1
【InChIKey】
InChIKey=AMZNHHZJURKRFX-SNVBAGLBSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)OC[C@H]2CCC(=O)N2
【MOL File】
(R)-(5-OXOPYRROLIDIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(R)-(5-OXOPYRROLIDIN-2-YL)METHYL 4-METHYLBENZENESULFONATE.cml