Home Halogens 1-bromo-4-(phenylsulfanylmethyl)benzene

1-bromo-4-(phenylsulfanylmethyl)benzene

CAS No.:
75954-35-7
Catalog Number:
AG01DIPH
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DIPH
Chemical Name:
1-bromo-4-(phenylsulfanylmethyl)benzene
CAS Number:
75954-35-7
Molecular Formula:
C13H11BrS
Molecular Weight:
279.1954
MDL Number:
MFCD00471947
IUPAC Name:
1-bromo-4-(phenylsulfanylmethyl)benzene
InChI:
InChI=1S/C13H11BrS/c14-12-8-6-11(7-9-12)10-15-13-4-2-1-3-5-13/h1-9H,10H2
InChI Key:
UREFTBXLBXYWNO-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)CSc1ccccc1
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