Home Other Building Blocks 2-Chlorothioanisole

2-Chlorothioanisole

CAS No.:
17733-22-1
Catalog Number:
AG00258U
Molecular Formula:
C7H7ClS
Molecular Weight:
158.6485
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
99%
1 week
United States
$55
- +
5g
99%
1 week
United States
$63
- +
25g
99%
1 week
United States
$125
- +
Product Description
Catalog Number:
AG00258U
Chemical Name:
2-Chlorothioanisole
CAS Number:
17733-22-1
Molecular Formula:
C7H7ClS
Molecular Weight:
158.6485
MDL Number:
MFCD00040124
IUPAC Name:
1-chloro-2-methylsulfanylbenzene
InChI:
InChI=1S/C7H7ClS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
InChI Key:
IHLDFHCSSCVPQW-UHFFFAOYSA-N
SMILES:
CSc1ccccc1Cl
Properties
Complexity:
85  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.996g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.643g/mol
Monoisotopic Mass:
157.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties