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Dinonyl Adipate

CAT: 1596-AR-F09683-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-F09683-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
151-32-6
Molecular Formula
C24H46O4
Molecular Weight
398.63
API Name
Fatty acid

Chemical Information

1,6-Dinonyl hexanedioate
CAS Number151-32-6
PubChem CID9029
IUPAC Namedinonyl hexanedioate
Molecular FormulaC24H46O4
Molecular Weight398.6
XLogP8.5
Topological Polar Surface Area52.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count23
Heavy Atom Count28
Formal Charge0
Complexity321
SMILES
CCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCC
InChI
InChI=1S/C24H46O4/c1-3-5-7-9-11-13-17-21-27-23(25)19-15-16-20-24(26)28-22-18-14-12-10-8-6-4-2/h3-22H2,1-2H3
InChIKey
WIYAGHSNPUBKDT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,6-Dinonyl hexanedioate
CAS: 151-32-6
CID: 9029
Formula: C24H46O4
MW: 398.6
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight398.6
XLogP38.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count23
Exact Mass398.33960994
Monoisotopic Mass398.33960994
Topological Polar Surface Area52.6 Ų
Heavy Atom Count28
Formal Charge0
Complexity321
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