Home Sulfos p-Toluenesulfonic acid phenethyl ester

p-Toluenesulfonic acid phenethyl ester

CAS No.:
4455-09-8
Catalog Number:
AG003TLD
Molecular Formula:
C15H16O3S
Molecular Weight:
276.3507
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$50
- +
25g
98%
In Stock USA
United States
$138
- +
100g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG003TLD
Chemical Name:
p-Toluenesulfonic acid phenethyl ester
CAS Number:
4455-09-8
Molecular Formula:
C15H16O3S
Molecular Weight:
276.3507
MDL Number:
MFCD00059322
IUPAC Name:
2-phenylethyl 4-methylbenzenesulfonate
InChI:
InChI=1S/C15H16O3S/c1-13-7-9-15(10-8-13)19(16,17)18-12-11-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChI Key:
CVPPUZPZPFOFPK-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)OCCc1ccccc1
NSC Number:
142250
Properties
Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.082g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.35g/mol
Monoisotopic Mass:
276.082g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties