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306277-20-3 | 4,5-Dichloro-2-methylbenzonitrile
CAS No: 306277-20-3 Catalog No: AG01FEIL MDL No:MFCD22566294
Product Description
Catalog Number:
AG01FEIL
Chemical Name:
4,5-Dichloro-2-methylbenzonitrile
CAS Number:
306277-20-3
Molecular Formula:
C8H5Cl2N
Molecular Weight:
186.0380
MDL Number:
MFCD22566294
IUPAC Name:
4,5-dichloro-2-methylbenzonitrile
InChI:
InChI=1S/C8H5Cl2N/c1-5-2-7(9)8(10)3-6(5)4-11/h2-3H,1H3
InChI Key:
RIKPGZSHDZBROU-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)c(cc1C)Cl
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.98g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.035g/mol
Monoisotopic Mass:
184.98g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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