Home Halogens 1-Benzylthio-4-bromobenzene

1-Benzylthio-4-bromobenzene

CAS No.:
53136-21-3
Catalog Number:
AG003E0Q
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$94
- +
10g
98%
In Stock USA
United States
$157
- +
25g
98%
In Stock USA
United States
$313
- +
100g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG003E0Q
Chemical Name:
1-Benzylthio-4-bromobenzene
CAS Number:
53136-21-3
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
MDL Number:
MFCD00028019
IUPAC Name:
1-benzylsulfanyl-4-bromobenzene
InChI:
InChI=1S/C13H11BrS/c14-12-6-8-13(9-7-12)15-10-11-4-2-1-3-5-11/h1-9H,10H2
InChI Key:
XNMPJRAVZAWQMD-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)SCc1ccccc1
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.976g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.195g/mol
Monoisotopic Mass:
277.976g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6  
Properties