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1,4-Cubanebis (dimethylamide)

CAT: 0862-GW7558-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0862-GW7558-100mgSize:100 mg
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CAS Number
133180-93-5
Storage Conditions
+4°C
Hazardous Class
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Chemical Information

1,4-Cubanebis(dimethylamide)
CAS Number133180-93-5
PubChem CID118797310
IUPAC Name1-N,1-N,4-N,4-N-tetramethylcubane-1,4-dicarboxamide
Molecular FormulaC14H18N2O2
Molecular Weight246.30
XLogP-0.8
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity434
SMILES
CN(C)C(=O)C12C3C4C1C5C2C3C45C(=O)N(C)C
InChI
InChI=1S/C14H18N2O2/c1-15(2)11(17)13-5-8-6(13)10-7(13)9(5)14(8,10)12(18)16(3)4/h5-10H,1-4H3
InChIKey
XQTVWELQOVLKQS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,4-Cubanebis(dimethylamide)
CAS: 133180-93-5
CID: 118797310
Formula: C14H18N2O2
MW: 246.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight246.30
XLogP3-0.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass246.136827821
Monoisotopic Mass246.136827821
Topological Polar Surface Area40.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity434
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