Home Nitriles 4-(4-Bromophenyl)-2-thiazoleacetonitrile

4-(4-Bromophenyl)-2-thiazoleacetonitrile

CAS No.:
94833-31-5
Catalog Number:
AG003K2M
Molecular Formula:
C11H7BrN2S
Molecular Weight:
279.1557
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$275
- +
10g
98%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG003K2M
Chemical Name:
4-(4-Bromophenyl)-2-thiazoleacetonitrile
CAS Number:
94833-31-5
Molecular Formula:
C11H7BrN2S
Molecular Weight:
279.1557
MDL Number:
MFCD00551793
IUPAC Name:
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]acetonitrile
InChI:
InChI=1S/C11H7BrN2S/c12-9-3-1-8(2-4-9)10-7-15-11(14-10)5-6-13/h1-4,7H,5H2
InChI Key:
VBHJUUAUIGGAPS-UHFFFAOYSA-N
SMILES:
N#CCc1scc(n1)c1ccc(cc1)Br
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.951g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.155g/mol
Monoisotopic Mass:
277.951g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties