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Home Sulfos 4-(Adamantan-1-yl)phenyl trifluoromethanesulfonate

4-(Adamantan-1-yl)phenyl trifluoromethanesulfonate

CAS No.:
263398-16-9
Catalog Number:
AG00BIGZ
Molecular Formula:
C17H19F3O3S
Molecular Weight:
360.3912
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$575
- +
Product Description
Catalog Number:
AG00BIGZ
Chemical Name:
4-(Adamantan-1-yl)phenyl trifluoromethanesulfonate
CAS Number:
263398-16-9
Molecular Formula:
C17H19F3O3S
Molecular Weight:
360.3912
MDL Number:
MFCD24448806
IUPAC Name:
[4-(1-adamantyl)phenyl] trifluoromethanesulfonate
InChI:
InChI=1S/C17H19F3O3S/c18-17(19,20)24(21,22)23-15-3-1-14(2-4-15)16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13H,5-10H2
InChI Key:
WFYDWLVJOHAMEA-UHFFFAOYSA-N
SMILES:
FC(S(=O)(=O)Oc1ccc(cc1)C12CC3CC(C2)CC(C1)C3)(F)F
Properties
Complexity:
544  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.101g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
360.391g/mol
Monoisotopic Mass:
360.101g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1  
Properties