Home Halogens 2-(3,5-Dichlorophenoxy)acetonitrile

2-(3,5-Dichlorophenoxy)acetonitrile

CAS No.:
103140-12-1
Catalog Number:
AG003ET2
Molecular Formula:
C8H5Cl2NO
Molecular Weight:
202.0374
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Product Description
Catalog Number:
AG003ET2
Chemical Name:
2-(3,5-Dichlorophenoxy)acetonitrile
CAS Number:
103140-12-1
Molecular Formula:
C8H5Cl2NO
Molecular Weight:
202.0374
MDL Number:
MFCD00052707
IUPAC Name:
2-(3,5-dichlorophenoxy)acetonitrile
InChI:
InChI=1S/C8H5Cl2NO/c9-6-3-7(10)5-8(4-6)12-2-1-11/h3-5H,2H2
InChI Key:
PNROREDTZJCOHF-UHFFFAOYSA-N
SMILES:
N#CCOc1cc(Cl)cc(c1)Cl
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.975g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.034g/mol
Monoisotopic Mass:
200.975g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties