Home Nitriles 2-Chloro-6-isopropylnicotinonitrile

2-Chloro-6-isopropylnicotinonitrile

CAS No.:
108244-44-6
Catalog Number:
AG009TIU
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG009TIU
Chemical Name:
2-Chloro-6-isopropylnicotinonitrile
CAS Number:
108244-44-6
Molecular Formula:
C9H9ClN2
Molecular Weight:
180.6342
MDL Number:
MFCD14581659
IUPAC Name:
2-chloro-6-propan-2-ylpyridine-3-carbonitrile
InChI:
InChI=1S/C9H9ClN2/c1-6(2)8-4-3-7(5-11)9(10)12-8/h3-4,6H,1-2H3
InChI Key:
KZXQCYPAMGNZPE-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1Cl)C(C)C
Properties
Complexity:
194  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.045g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.635g/mol
Monoisotopic Mass:
180.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties