Home Sulfos tert-Butyl 3-{[(4-methylbenzene)sulfonyl]oxy}pyrrolidine-1-carboxylate

tert-Butyl 3-{[(4-methylbenzene)sulfonyl]oxy}pyrrolidine-1-carboxylate

CAS No.:
103057-45-0
Catalog Number:
AG00865A
Molecular Formula:
C16H23NO5S
Molecular Weight:
341.4225
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$313
- +
5g
97%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00865A
Chemical Name:
tert-Butyl 3-{[(4-methylbenzene)sulfonyl]oxy}pyrrolidine-1-carboxylate
CAS Number:
103057-45-0
Molecular Formula:
C16H23NO5S
Molecular Weight:
341.4225
MDL Number:
MFCD07787191
IUPAC Name:
tert-butyl 3-(4-methylphenyl)sulfonyloxypyrrolidine-1-carboxylate
InChI:
InChI=1S/C16H23NO5S/c1-12-5-7-14(8-6-12)23(19,20)22-13-9-10-17(11-13)15(18)21-16(2,3)4/h5-8,13H,9-11H2,1-4H3
InChI Key:
MWACHFODPQVXHF-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)OC1CCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
512  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.13g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
341.422g/mol
Monoisotopic Mass:
341.13g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
81.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties