tert-Butyl 3-((((trifluoromethyl)sulfonyl)oxy)methyl)pyrrolidine-1-carboxylate

HCID 53385508

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Basic information

CAS
305329-96-8
Standard SMILES
CC(C)(C)OC(=O)N1CCC(COS(=O)(=O)C(F)(F)F)C1
InChIKey
XMNCGYHYYHDHEK-UHFFFAOYSA-N
Molecular formula
C11H18F3NO5S
Average molar mass
333.33 g/mol
Monoisotopic mass
333.08577833

Names & identifiers

Preferred name
tert-Butyl 3-((((trifluoromethyl)sulfonyl)oxy)methyl)pyrrolidine-1-carboxylate
IUPAC
tert-butyl 3-(trifluoromethylsulfonyloxymethyl)pyrrolidine-1-carboxylate

Names & synonyms

305329-96-8tert-Butyl 3-((((trifluoromethyl)sulfonyl)oxy)methyl)pyrrolidine-1-carboxylate3-Trifluoromethanesulfonyloxymethyl-pyrrolidine-1-carboxylic acid tert-butyl esterTERT-BUTYL 3-[(TRIFLUOROMETHANESULFONYLOXY)METHYL]PYRROLIDINE-1-CARBOXYLATEtert-butyl 3-((trifluoromethylsulfonyloxy)methyl)pyrrolidine-1-carboxylateSCHEMBL6058771DTXSID90693743AKOS015907494DB-110228tert-Butyl 3-{[(trifluoromethanesulfonyl)oxy]methyl}pyrrolidine-1-carboxylate

Database identifiers

CAS
305329-96-8
PubChem CID
53385508
DTXSID
DTXSID90693743

Properties

Computed structural propertiesFilling in

XLogP
2.1
Topological polar surface area
81.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
21

Related reactions

2 records

Compound notes

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