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Home Other Building Blocks 2-Tosylethanol

2-Tosylethanol

CAS No.:
22381-54-0
Catalog Number:
AG003G81
Molecular Formula:
C9H12O3S
Molecular Weight:
200.2548
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$12
- +
5g
>95.0%(GC)
1 week
United States
$173
- +
Product Description
Catalog Number:
AG003G81
Chemical Name:
2-Tosylethanol
CAS Number:
22381-54-0
Molecular Formula:
C9H12O3S
Molecular Weight:
200.2548
MDL Number:
MFCD00041757
IUPAC Name:
2-(4-methylphenyl)sulfonylethanol
InChI:
InChI=1S/C9H12O3S/c1-8-2-4-9(5-3-8)13(11,12)7-6-10/h2-5,10H,6-7H2,1H3
InChI Key:
QJFIXBNLKARINT-UHFFFAOYSA-N
SMILES:
OCCS(=O)(=O)c1ccc(cc1)C
NSC Number:
70003
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.252g/mol
Monoisotopic Mass:
200.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Literature
Title Journal
Novel coumarins and 2-thioxo-coumarins as inhibitors of the tumor-associated carbonic anhydrases IX and XII. Bioorganic & medicinal chemistry 20120401
Properties