Home Sulfos 1-Methyl-1,2,3,6-tetrahydropyridin-4-yl trifluoromethanesulfonate

1-Methyl-1,2,3,6-tetrahydropyridin-4-yl trifluoromethanesulfonate

CAS No.:
180692-27-7
Catalog Number:
AG00228E
Molecular Formula:
C7H10F3NO3S
Molecular Weight:
245.2194
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$253
- +
1g
97%
1 week
United States
$388
- +
5g
97%
1 week
United States
$1088
- +
Product Description
Catalog Number:
AG00228E
Chemical Name:
1-Methyl-1,2,3,6-tetrahydropyridin-4-yl trifluoromethanesulfonate
CAS Number:
180692-27-7
Molecular Formula:
C7H10F3NO3S
Molecular Weight:
245.2194
MDL Number:
MFCD22690664
IUPAC Name:
(1-methyl-3,6-dihydro-2H-pyridin-4-yl) trifluoromethanesulfonate
InChI:
InChI=1S/C7H10F3NO3S/c1-11-4-2-6(3-5-11)14-15(12,13)7(8,9)10/h2H,3-5H2,1H3
InChI Key:
VLJCJEJRGHGDMQ-UHFFFAOYSA-N
SMILES:
CN1CCC(=CC1)OS(=O)(=O)C(F)(F)F
Properties
Complexity:
355  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.033g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.216g/mol
Monoisotopic Mass:
245.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties