Home Halogens (2,6-Dichlorophenylthio)acetic acid

(2,6-Dichlorophenylthio)acetic acid

CAS No.:
21248-45-3
Catalog Number:
AG003BL5
Molecular Formula:
C8H6Cl2O2S
Molecular Weight:
237.1030
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$270
- +
5g
1 week
United States
$1082
- +
10g
1 week
United States
$1709
- +
25g
1 week
United States
$2962
- +
Product Description
Catalog Number:
AG003BL5
Chemical Name:
(2,6-Dichlorophenylthio)acetic acid
CAS Number:
21248-45-3
Molecular Formula:
C8H6Cl2O2S
Molecular Weight:
237.1030
MDL Number:
MFCD00052108
IUPAC Name:
2-(2,6-dichlorophenyl)sulfanylacetic acid
InChI:
InChI=1S/C8H6Cl2O2S/c9-5-2-1-3-6(10)8(5)13-4-7(11)12/h1-3H,4H2,(H,11,12)
InChI Key:
URNRRSJGOOTQBO-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1c(Cl)cccc1Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.947g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.094g/mol
Monoisotopic Mass:
235.947g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties