Home Halogens 3,5-Dichlorothioanisole

3,5-Dichlorothioanisole

CAS No.:
68121-46-0
Catalog Number:
AG003IM7
Molecular Formula:
C7H6Cl2S
Molecular Weight:
193.0935
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$52
- +
5g
98%
1 week
United States
$70
- +
25g
98%
1 week
United States
$175
- +
Product Description
Catalog Number:
AG003IM7
Chemical Name:
3,5-Dichlorothioanisole
CAS Number:
68121-46-0
Molecular Formula:
C7H6Cl2S
Molecular Weight:
193.0935
MDL Number:
MFCD00870149
IUPAC Name:
1,3-dichloro-5-methylsulfanylbenzene
InChI:
InChI=1S/C7H6Cl2S/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3
InChI Key:
PSSCMQMQOXVMFG-UHFFFAOYSA-N
SMILES:
CSc1cc(Cl)cc(c1)Cl
Properties
Complexity:
97.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.957g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.085g/mol
Monoisotopic Mass:
191.957g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties