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147249-41-0 | Benzonitrile, 6-amino-2,3-dichloro-
CAS No: 147249-41-0 Catalog No: AG001EQV MDL No:MFCD00728602
Product Description
Catalog Number:
AG001EQV
Chemical Name:
Benzonitrile, 6-amino-2,3-dichloro-
CAS Number:
147249-41-0
Molecular Formula:
C7H4Cl2N2
Molecular Weight:
187.0261
MDL Number:
MFCD00728602
IUPAC Name:
6-amino-2,3-dichlorobenzonitrile
InChI:
InChI=1S/C7H4Cl2N2/c8-5-1-2-6(11)4(3-10)7(5)9/h1-2H,11H2
InChI Key:
RYMBKSPMCKFIGN-UHFFFAOYSA-N
SMILES:
N#Cc1c(N)ccc(c1Cl)Cl
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.975g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.023g/mol
Monoisotopic Mass:
185.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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