Home  > Piperazine-1,4-bis(ethanesulfonic acid) monosodium salt hydrate

AA01013

10010-67-0 | Piperazine-1,4-bis(ethanesulfonic acid) monosodium salt hydrate

Packsize Purity Availability Price Discounted Price    Quantity
5g 98% In Stock US $40.00 $28.00 -   +
25g 98% In Stock US $69.00 $48.00 -   +
100g 98% In Stock US $148.00 $103.00 -   +
250g 98% In Stock US $295.00 $206.00 -   +

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*All prices are in USD.

Description
Catalog Number: AA01013
Chemical Name: Piperazine-1,4-bis(ethanesulfonic acid) monosodium salt hydrate
CAS Number: 10010-67-0
Molecular Formula: C8H17N2NaO6S2
Molecular Weight: 324.3502
MDL Number: MFCD00065472
IUPAC Name: sodium;2-[4-(2-sulfoethyl)piperazin-1-yl]ethanesulfonate
InChl: InChI=1S/C8H18N2O6S2.Na/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16;/h1-8H2,(H,11,12,13)(H,14,15,16);/q;+1/p-1
InChl Key: OGGAIRCLBMGXCZ-UHFFFAOYSA-M
SMILES: [O-]S(=O)(=O)CCN1CCN(CC1)CCS(=O)(=O)O.[Na+]

 

Computed Properties
Complexity: 447  
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 324.043g/mol
Formal Charge: 0
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 8  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0
Molecular Weight: 324.342g/mol
Monoisotopic Mass: 324.043g/mol
Rotatable Bond Count: 6  
Topological Polar Surface Area: 135A^2
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0

 

 

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