Home Halogens Benzenethiol, 3-chloro-4-methoxy-

Benzenethiol, 3-chloro-4-methoxy-

CAS No.:
89818-37-1
Catalog Number:
AG0086K1
Molecular Formula:
C7H7ClOS
Molecular Weight:
174.6479
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
90%
1 week
United States
$274
- +
1g
90%
1 week
United States
$559
- +
5g
90%
1 week
United States
$1600
- +
25g
90%
1 week
United States
$6288
- +
Product Description
Catalog Number:
AG0086K1
Chemical Name:
Benzenethiol, 3-chloro-4-methoxy-
CAS Number:
89818-37-1
Molecular Formula:
C7H7ClOS
Molecular Weight:
174.6479
MDL Number:
MFCD00068902
IUPAC Name:
3-chloro-4-methoxybenzenethiol
InChI:
InChI=1S/C7H7ClOS/c1-9-7-3-2-5(10)4-6(7)8/h2-4,10H,1H3
InChI Key:
ITMCBTAXLFTDPQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1Cl)S
Properties
Complexity:
110  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.991g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
174.642g/mol
Monoisotopic Mass:
173.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties