Home Sulfos 1-(3-Bromo-5-trifluoromethylphenylsulfonyl)pyrrolidine

1-(3-Bromo-5-trifluoromethylphenylsulfonyl)pyrrolidine

CAS No.:
951884-59-6
Catalog Number:
AG00IIT0
Molecular Formula:
C11H11BrF3NO2S
Molecular Weight:
358.1747
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
10g
95%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00IIT0
Chemical Name:
1-(3-Bromo-5-trifluoromethylphenylsulfonyl)pyrrolidine
CAS Number:
951884-59-6
Molecular Formula:
C11H11BrF3NO2S
Molecular Weight:
358.1747
MDL Number:
MFCD09801012
IUPAC Name:
1-[3-bromo-5-(trifluoromethyl)phenyl]sulfonylpyrrolidine
InChI:
InChI=1S/C11H11BrF3NO2S/c12-9-5-8(11(13,14)15)6-10(7-9)19(17,18)16-3-1-2-4-16/h5-7H,1-4H2
InChI Key:
CQJNMANCWRRNDY-UHFFFAOYSA-N
SMILES:
Brc1cc(cc(c1)C(F)(F)F)S(=O)(=O)N1CCCC1
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.965g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.173g/mol
Monoisotopic Mass:
356.965g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties