Home Halogens Methyl 2,6-dichloro-4-cyanobenzoate

Methyl 2,6-dichloro-4-cyanobenzoate

CAS No.:
409127-32-8
Catalog Number:
AG0073Y7
Molecular Formula:
C9H5Cl2NO2
Molecular Weight:
230.0475
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
1 week
United States
$152
- +
250mg
98%
1 week
United States
$264
- +
Product Description
Catalog Number:
AG0073Y7
Chemical Name:
Methyl 2,6-dichloro-4-cyanobenzoate
CAS Number:
409127-32-8
Molecular Formula:
C9H5Cl2NO2
Molecular Weight:
230.0475
MDL Number:
MFCD13194678
IUPAC Name:
methyl 2,6-dichloro-4-cyanobenzoate
InChI:
InChI=1S/C9H5Cl2NO2/c1-14-9(13)8-6(10)2-5(4-12)3-7(8)11/h2-3H,1H3
InChI Key:
SFGSLCVSCBZCIC-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(Cl)cc(cc1Cl)C#N
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.97g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.044g/mol
Monoisotopic Mass:
228.97g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties