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CP 20961

CAT: 0024-sc-361156Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0024-sc-361156Size:10 mg
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CAS Number
35607-20-6

Chemical Information

Avridine

Avridine is an amino alcohol.

CAS Number35607-20-6
PubChem CID37186
IUPAC Name2-[3-(dioctadecylamino)propyl-(2-hydroxyethyl)amino]ethanol
Molecular FormulaC43H90N2O2
Molecular Weight667.2
XLogP17
Topological Polar Surface Area46.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count42
Heavy Atom Count47
Formal Charge0
Complexity504
SMILES
CCCCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCCCC)CCCN(CCO)CCO
InChI
InChI=1S/C43H90N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-44(38-35-39-45(40-42-46)41-43-47)37-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h46-47H,3-43H2,1-2H3
InChIKey
WXNRAKRZUCLRBP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Avridine
CAS: 35607-20-6
CID: 37186
Formula: C43H90N2O2
MW: 667.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight667.2
XLogP317
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count42
Exact Mass666.70023012
Monoisotopic Mass666.70023012
Topological Polar Surface Area46.9 Ų
Heavy Atom Count47
Formal Charge0
Complexity504
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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