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HEPPSO sodium

CAT: 0013-GTR19244981-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19244981-02Size:100 mg
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Description
HEPPSO (sodium) is a biological buffering agent, suitable for use as a biomaterial or organic compound in life science research.
CAS Number
89648-37-3
Smiles
O=S (CC (O) CN1CCN (CCO) CC1) (O[Na]) =O
Molecular Formula
C9H19N2NaO5S
Molecular Weight
290.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Sodium 2-hydroxy-1-(4-(2-hydroxyethyl)piperazin-1-yl)propane-1-sulfonate
CAS Number89648-37-3
PubChem CID71306762
IUPAC Namesodium 2-hydroxy-1-[4-(2-hydroxyethyl)piperazin-1-yl]propane-1-sulfonate
Molecular FormulaC9H19N2NaO5S
Molecular Weight290.31
Topological Polar Surface Area113
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity326
SMILES
CC(C(N1CCN(CC1)CCO)S(=O)(=O)[O-])O.[Na+]
InChI
InChI=1S/C9H20N2O5S.Na/c1-8(13)9(17(14,15)16)11-4-2-10(3-5-11)6-7-12;/h8-9,12-13H,2-7H2,1H3,(H,14,15,16);/q;+1/p-1
InChIKey
JKPPLRCAXJSWBR-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Sodium 2-hydroxy-1-(4-(2-hydroxyethyl)piperazin-1-yl)propane-1-sulfonate
CAS: 89648-37-3
CID: 71306762
Formula: C9H19N2NaO5S
MW: 290.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight290.31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass290.09123717
Monoisotopic Mass290.09123717
Topological Polar Surface Area113 Ų
Heavy Atom Count18
Formal Charge0
Complexity326
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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