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HEPPS

CAT: 0862-GB8306-25gSize: 25 gDry Ice: NoHazardous: No
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CAT#:0862-GB8306-25gSize:25 g
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CAS Number
16052-06-5
EC Number
240-198-8
MDL Number
MFCD00006160
HS Code
29335995
Purity
99.00%
Molecular Formula
C9H20N2O4S
Molecular Weight
252.33
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Hepps

HEPPS is a N-(2-hydroxyethyl)piperazine and a N-(sulfoalkyl)piperazine.

CAS Number16052-06-5
PubChem CID85255
IUPAC Name3-[4-(2-hydroxyethyl)piperazin-1-yl]propane-1-sulfonic acid
Molecular FormulaC9H20N2O4S
Molecular Weight252.33
XLogP-3.6
Topological Polar Surface Area89.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count16
Formal Charge0
Complexity280
SMILES
C1CN(CCN1CCCS(=O)(=O)O)CCO
InChI
InChI=1S/C9H20N2O4S/c12-8-7-11-5-3-10(4-6-11)2-1-9-16(13,14)15/h12H,1-9H2,(H,13,14,15)
InChIKey
OWXMKDGYPWMGEB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hepps
CAS: 16052-06-5
CID: 85255
Formula: C9H20N2O4S
MW: 252.33
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight252.33
XLogP3-3.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass252.11437830
Monoisotopic Mass252.11437830
Topological Polar Surface Area89.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity280
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes