Home Nitriles 4-Chloro-2,5-dimethylbenzonitrile

4-Chloro-2,5-dimethylbenzonitrile

CAS No.:
90537-15-8
Catalog Number:
AG01EYZI
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
90%
1 week
United States
$246
- +
1g
90%
1 week
United States
$420
- +
Product Description
Catalog Number:
AG01EYZI
Chemical Name:
4-Chloro-2,5-dimethylbenzonitrile
CAS Number:
90537-15-8
Molecular Formula:
C9H8ClN
Molecular Weight:
165.6195
MDL Number:
MFCD19381656
IUPAC Name:
4-chloro-2,5-dimethylbenzonitrile
InChI:
InChI=1S/C9H8ClN/c1-6-4-9(10)7(2)3-8(6)5-11/h3-4H,1-2H3
InChI Key:
OYYVQLONMLSVAG-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)c(cc1C)Cl
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.62g/mol
Monoisotopic Mass:
165.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties