Home Nitriles 4-Chloro-3-formylbenzonitrile

4-Chloro-3-formylbenzonitrile

CAS No.:
105191-41-1
Catalog Number:
AG0085B4
Molecular Formula:
C8H4ClNO
Molecular Weight:
165.5765
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$55
- +
5g
98%
In Stock USA
United States
$183
- +
10g
98%
In Stock USA
United States
$292
- +
25g
98%
In Stock USA
United States
$654
- +
100g
98%
In Stock USA
United States
$1975
- +
Product Description
Catalog Number:
AG0085B4
Chemical Name:
4-Chloro-3-formylbenzonitrile
CAS Number:
105191-41-1
Molecular Formula:
C8H4ClNO
Molecular Weight:
165.5765
MDL Number:
MFCD11035756
IUPAC Name:
4-chloro-3-formylbenzonitrile
InChI:
InChI=1S/C8H4ClNO/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3,5H
InChI Key:
JVRHVSUFKIQVFN-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C#N)ccc1Cl
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.998g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.576g/mol
Monoisotopic Mass:
164.998g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties