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Zwittergent 3-16

CAT: 0931-T65361-01Size: 5 gDry Ice: NoHazardous: No
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CAT#:0931-T65361-01Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2281-11-0
Target
Others
Related Pathways
Others
Purity
0.9992
Bioactivity
ZWITTERGENT 3-16 Detergent is a quaternary ammonium surfactant, emulsifier, foaming and wetting agent commonly used in the skin care industry.ZWITTERGENT 3-16 Detergent is involved in protein purification.
Smiles
O=S(=O)([O-])CCC[N+](C)(C)CCCCCCCCCCCCCCCC
Molecular Formula
C21H45NO3S
Molecular Weight
391.65
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-Hexadecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate
CAS Number2281-11-0
PubChem CID92176
IUPAC Name3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate
Molecular FormulaC21H45NO3S
Molecular Weight391.7
XLogP7.2
Topological Polar Surface Area65.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count18
Heavy Atom Count26
Formal Charge0
Complexity389
SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
InChI
InChI=1S/C21H45NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-26(23,24)25/h4-21H2,1-3H3
InChIKey
TUBRCQBRKJXJEA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Hexadecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate
CAS: 2281-11-0
CID: 92176
Formula: C21H45NO3S
MW: 391.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight391.7
XLogP37.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count18
Exact Mass391.31201547
Monoisotopic Mass391.31201547
Topological Polar Surface Area65.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity389
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

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Alternative Products

CatalogName
BUP18749-01Zwittergent 3-16
sc-281194DZWITTERGENT 3-16 Detergent
469261-01ZWITTERGENT 3-12 Detergent
sc-281193BZwittergent 3-14 detergent
MBS5807975Zwittergent 3-12 Detergent
sc-281191ZWITTERGENT 3-10 Detergent
P-803Connector Barbed 3/16 x 3/16
P-137XNutSFPEEKBlk5/16-24-3/16/10Pk
CHR4537Kinesis Connector Barbed 3/16 x 3/16
1777-25GSulfobetaine 3-16

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