Home Sulfos 1-Phenyl-2,5,8,11-tetraoxatridecan-13-yl 4-methylbenzenesulfonate

1-Phenyl-2,5,8,11-tetraoxatridecan-13-yl 4-methylbenzenesulfonate

CAS No.:
89346-82-7
Catalog Number:
AG003Y1Y
Molecular Formula:
C22H32O8S
Molecular Weight:
456.5497
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$433
- +
Product Description
Catalog Number:
AG003Y1Y
Chemical Name:
1-Phenyl-2,5,8,11-tetraoxatridecan-13-yl 4-methylbenzenesulfonate
CAS Number:
89346-82-7
Molecular Formula:
C22H32O8S
Molecular Weight:
456.5497
MDL Number:
MFCD29060061
IUPAC Name:
4-methylbenzenesulfonic acid;2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethanol
InChI:
InChI=1S/C15H24O5.C7H8O3S/c16-6-7-17-8-9-18-10-11-19-12-13-20-14-15-4-2-1-3-5-15;1-6-2-4-7(5-3-6)11(8,9)10/h1-5,16H,6-14H2;2-5H,1H3,(H,8,9,10)
InChI Key:
QKSWDGZLFCCSNQ-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)O.OCCOCCOCCOCCOCc1ccccc1
Properties
Complexity:
401  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
456.182g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
456.55g/mol
Monoisotopic Mass:
456.182g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties