Home Halogens 3',5'-Dichloroacetophenone

3',5'-Dichloroacetophenone

CAS No.:
14401-72-0
Catalog Number:
AG001ISO
Molecular Formula:
C8H6Cl2O
Molecular Weight:
189.0386
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$18
- +
5g
97%
In Stock USA
United States
$54
- +
10g
97%
In Stock USA
United States
$94
- +
25g
97%
In Stock USA
United States
$125
- +
100g
97%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG001ISO
Chemical Name:
3',5'-Dichloroacetophenone
CAS Number:
14401-72-0
Molecular Formula:
C8H6Cl2O
Molecular Weight:
189.0386
MDL Number:
MFCD00045189
IUPAC Name:
1-(3,5-dichlorophenyl)ethanone
InChI:
InChI=1S/C8H6Cl2O/c1-5(11)6-2-7(9)4-8(10)3-6/h2-4H,1H3
InChI Key:
JGMBBKVZFUHCJC-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(Cl)cc(c1)Cl
Properties
Complexity:
148  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.98g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.035g/mol
Monoisotopic Mass:
187.98g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
3,5-Dichloro-salicylaldehyde. Acta crystallographica. Section E, Structure reports online 20080501
Properties