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

2-Isobutyl-1,3-dithiane

CAS No.:
69824-23-3
Catalog Number:
AG003HH5
Molecular Formula:
C8H16S2
Molecular Weight:
176.3426
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$19
- +
5g
95%
In Stock USA
United States
$54
- +
25g
95%
In Stock USA
United States
$200
- +
100g
95%
In Stock USA
United States
$638
- +
Product Description
Catalog Number:
AG003HH5
Chemical Name:
2-Isobutyl-1,3-dithiane
CAS Number:
69824-23-3
Molecular Formula:
C8H16S2
Molecular Weight:
176.3426
MDL Number:
MFCD00040290
IUPAC Name:
2-(2-methylpropyl)-1,3-dithiane
InChI:
InChI=1S/C8H16S2/c1-7(2)6-8-9-4-3-5-10-8/h7-8H,3-6H2,1-2H3
InChI Key:
WGIHYSKTNRQNHP-UHFFFAOYSA-N
SMILES:
CC(CC1SCCCS1)C
Properties
Complexity:
85.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.069g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.336g/mol
Monoisotopic Mass:
176.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties