Home Sulfos 1-(Methylsulfonyl)-1,4-diazepane, HCl

1-(Methylsulfonyl)-1,4-diazepane, HCl

CAS No.:
550369-26-1
Catalog Number:
AG00DD6J
Molecular Formula:
C6H14N2O2S
Molecular Weight:
178.2526
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
95%
In Stock USA
United States
$544
- +
1g
95%
In Stock USA
United States
$675
- +
Product Description
Catalog Number:
AG00DD6J
Chemical Name:
1-(Methylsulfonyl)-1,4-diazepane, HCl
CAS Number:
550369-26-1
Molecular Formula:
C6H14N2O2S
Molecular Weight:
178.2526
MDL Number:
MFCD08444716
IUPAC Name:
1-methylsulfonyl-1,4-diazepane
InChI:
InChI=1S/C6H14N2O2S/c1-11(9,10)8-5-2-3-7-4-6-8/h7H,2-6H2,1H3
InChI Key:
HWXMTJPGLBLECG-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)N1CCNCCC1
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.078g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
178.25g/mol
Monoisotopic Mass:
178.078g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties