Home Other Building Blocks 2-Phenyl-1,3-dithiane

2-Phenyl-1,3-dithiane

CAS No.:
5425-44-5
Catalog Number:
AG003HUU
Molecular Formula:
C10H12S2
Molecular Weight:
196.3323
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>98.0%(GC)
1 week
United States
$274
- +
Product Description
Catalog Number:
AG003HUU
Chemical Name:
2-Phenyl-1,3-dithiane
CAS Number:
5425-44-5
Molecular Formula:
C10H12S2
Molecular Weight:
196.3323
MDL Number:
MFCD00006656
IUPAC Name:
2-phenyl-1,3-dithiane
InChI:
InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2
InChI Key:
GXKPARDRBFURON-UHFFFAOYSA-N
SMILES:
C1CSC(SC1)c1ccccc1
EC Number:
226-568-1
UNII:
53TCS8B01P
NSC Number:
12763
Properties
Complexity:
124  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.038g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.326g/mol
Monoisotopic Mass:
196.038g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Cysteinyl peptide capture for shotgun proteomics: global assessment of chemoselective fractionation. Journal of proteome research 20101001
Properties