Home Halogens 2-(Benzylthio)-5-bromopyrimidine

2-(Benzylthio)-5-bromopyrimidine

CAS No.:
79686-18-3
Catalog Number:
AG008LND
Molecular Formula:
C11H9BrN2S
Molecular Weight:
281.1716
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG008LND
Chemical Name:
2-(Benzylthio)-5-bromopyrimidine
CAS Number:
79686-18-3
Molecular Formula:
C11H9BrN2S
Molecular Weight:
281.1716
MDL Number:
MFCD16660315
IUPAC Name:
2-benzylsulfanyl-5-bromopyrimidine
InChI:
InChI=1S/C11H9BrN2S/c12-10-6-13-11(14-7-10)15-8-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
LXOANVAJTYXINB-UHFFFAOYSA-N
SMILES:
Brc1cnc(nc1)SCc1ccccc1
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.967g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.171g/mol
Monoisotopic Mass:
279.967g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties