Home Sulfos 1-cyclopentyl-1,4-diazepane bis(4-methylbenzenesulfonate)

1-cyclopentyl-1,4-diazepane bis(4-methylbenzenesulfonate)

CAS No.:
1255718-36-5
Catalog Number:
AG019EK5
Molecular Formula:
C24H36N2O6S2
Molecular Weight:
512.6824
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG019EK5
Chemical Name:
1-cyclopentyl-1,4-diazepane bis(4-methylbenzenesulfonate)
CAS Number:
1255718-36-5
Molecular Formula:
C24H36N2O6S2
Molecular Weight:
512.6824
MDL Number:
MFCD13193850
IUPAC Name:
1-cyclopentyl-1,4-diazepane;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C10H20N2.2C7H8O3S/c1-2-5-10(4-1)12-8-3-6-11-7-9-12;2*1-6-2-4-7(5-3-6)11(8,9)10/h10-11H,1-9H2;2*2-5H,1H3,(H,8,9,10)
InChI Key:
JGCATNMZNWTOKP-UHFFFAOYSA-N
SMILES:
N1CCCN(CC1)C1CCCC1.Cc1ccc(cc1)S(=O)(=O)O.Cc1ccc(cc1)S(=O)(=O)O
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
512.201g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
512.68g/mol
Monoisotopic Mass:
512.201g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties