sales@angenesci.com
Login | Register
logo
Structures Search
Home Halogens 3,5-Dichlorobenzonitrile

3,5-Dichlorobenzonitrile

CAS No.:
6575-00-4
Catalog Number:
AG003ILS
Molecular Formula:
C7H3Cl2N
Molecular Weight:
172.0114
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
97%
In Stock USA
United States
$19
- +
25g
97%
In Stock USA
United States
$50
- +
100g
97%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG003ILS
Chemical Name:
3,5-Dichlorobenzonitrile
CAS Number:
6575-00-4
Molecular Formula:
C7H3Cl2N
Molecular Weight:
172.0114
MDL Number:
MFCD00001800
IUPAC Name:
3,5-dichlorobenzonitrile
InChI:
InChI=1S/C7H3Cl2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3H
InChI Key:
PUJSUOGJGIECFQ-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)cc(c1)Cl
EC Number:
229-495-3
NSC Number:
109596
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.964g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.008g/mol
Monoisotopic Mass:
170.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Primary effect of bromoxynil to induce plant cell death may be cytosol acidification. Journal of plant research 20080301
Nitrobenzene compounds inhibit expression of VCAM-1. Bioorganic & medicinal chemistry letters 20010723
Properties