Home Other Building Blocks (4-Bromo-2-fluorophenyl)(4-methoxybenzyl)sulfane

(4-Bromo-2-fluorophenyl)(4-methoxybenzyl)sulfane

CAS No.:
1020253-12-6
Catalog Number:
AG0006D6
Molecular Formula:
C14H12BrFOS
Molecular Weight:
327.2119
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$150
- +
5g
95%
In Stock USA
United States
$450
- +
Product Description
Catalog Number:
AG0006D6
Chemical Name:
(4-Bromo-2-fluorophenyl)(4-methoxybenzyl)sulfane
CAS Number:
1020253-12-6
Molecular Formula:
C14H12BrFOS
Molecular Weight:
327.2119
MDL Number:
MFCD09972171
IUPAC Name:
4-bromo-2-fluoro-1-[(4-methoxyphenyl)methylsulfanyl]benzene
InChI:
InChI=1S/C14H12BrFOS/c1-17-12-5-2-10(3-6-12)9-18-14-7-4-11(15)8-13(14)16/h2-8H,9H2,1H3
InChI Key:
XDHSLAPCAYVIAB-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CSc1ccc(cc1F)Br
Properties
Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.978g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
327.211g/mol
Monoisotopic Mass:
325.978g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties