Home Sulfos P-Toluenesulfonic acid n-hexyl ester

P-Toluenesulfonic acid n-hexyl ester

CAS No.:
3839-35-8
Catalog Number:
AG003U10
Molecular Formula:
C13H20O3S
Molecular Weight:
256.3611
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$44
- +
25g
95%
In Stock USA
United States
$119
- +
100g
95%
In Stock USA
United States
$357
- +
Product Description
Catalog Number:
AG003U10
Chemical Name:
P-Toluenesulfonic acid n-hexyl ester
CAS Number:
3839-35-8
Molecular Formula:
C13H20O3S
Molecular Weight:
256.3611
MDL Number:
MFCD00059439
IUPAC Name:
hexyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C13H20O3S/c1-3-4-5-6-11-16-17(14,15)13-9-7-12(2)8-10-13/h7-10H,3-6,11H2,1-2H3
InChI Key:
IVQOVYWBHRSGJI-UHFFFAOYSA-N
SMILES:
CCCCCCOS(=O)(=O)c1ccc(cc1)C
NSC Number:
3219
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.113g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.36g/mol
Monoisotopic Mass:
256.113g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties