Home Nitriles 4-(4-Methylthiazol-5-yl)benzonitrile

4-(4-Methylthiazol-5-yl)benzonitrile

CAS No.:
122957-57-7
Catalog Number:
AG01C1EI
Molecular Formula:
C11H8N2S
Molecular Weight:
200.2596
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$168
- +
Product Description
Catalog Number:
AG01C1EI
Chemical Name:
4-(4-Methylthiazol-5-yl)benzonitrile
CAS Number:
122957-57-7
Molecular Formula:
C11H8N2S
Molecular Weight:
200.2596
MDL Number:
MFCD29041978
IUPAC Name:
4-(4-methyl-1,3-thiazol-5-yl)benzonitrile
InChI:
InChI=1S/C11H8N2S/c1-8-11(14-7-13-8)10-4-2-9(6-12)3-5-10/h2-5,7H,1H3
InChI Key:
REUDLMVWBUGLDA-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)c1scnc1C
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.041g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.259g/mol
Monoisotopic Mass:
200.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties