Home Other Building Blocks 2-Hydroxy-3-(methylthio)benzoic acid

2-Hydroxy-3-(methylthio)benzoic acid

CAS No.:
67127-64-4
Catalog Number:
AG019ESO
Molecular Formula:
C8H8O3S
Molecular Weight:
184.2123
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$413
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Product Description
Catalog Number:
AG019ESO
Chemical Name:
2-Hydroxy-3-(methylthio)benzoic acid
CAS Number:
67127-64-4
Molecular Formula:
C8H8O3S
Molecular Weight:
184.2123
MDL Number:
MFCD16999038
IUPAC Name:
2-hydroxy-3-methylsulfanylbenzoic acid
InChI:
InChI=1S/C8H8O3S/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4,9H,1H3,(H,10,11)
InChI Key:
TZRMFKCHBWZNIF-UHFFFAOYSA-N
SMILES:
CSc1cccc(c1O)C(=O)O
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.019g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
184.209g/mol
Monoisotopic Mass:
184.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties