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Uvinul 3030

CAT: 1596-AR-U01434-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-U01434-02Size:25 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
178671-58-4
Synonyms
2,2-bis (((2-cyano-3,3-diphenylacryloyl) oxy) methyl) propane-1,3-diyl bis (2-cyano-3,3-diphenylacrylate)
Molecular Formula
C69H48N4O8
Molecular Weight
1061.16
API Name
Uvinul

Chemical Information

2-Propenoic acid, 2-cyano-3,3-diphenyl-2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxy)methyl)-1,3-propanediyl ester
CAS Number178671-58-4
PubChem CID16134382
IUPAC Name[3-(2-cyano-3,3-diphenylprop-2-enoyl)oxy-2,2-bis[(2-cyano-3,3-diphenylprop-2-enoyl)oxymethyl]propyl] 2-cyano-3,3-diphenylprop-2-enoate
Molecular FormulaC69H48N4O8
Molecular Weight1061.1
XLogP15.5
Topological Polar Surface Area200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count24
Heavy Atom Count81
Formal Charge0
Complexity2070
SMILES
C1=CC=C(C=C1)C(=C(C#N)C(=O)OCC(COC(=O)C(=C(C2=CC=CC=C2)C3=CC=CC=C3)C#N)(COC(=O)C(=C(C4=CC=CC=C4)C5=CC=CC=C5)C#N)COC(=O)C(=C(C6=CC=CC=C6)C7=CC=CC=C7)C#N)C8=CC=CC=C8
InChI
InChI=1S/C69H48N4O8/c70-41-57(61(49-25-9-1-10-26-49)50-27-11-2-12-28-50)65(74)78-45-69(46-79-66(75)58(42-71)62(51-29-13-3-14-30-51)52-31-15-4-16-32-52,47-80-67(76)59(43-72)63(53-33-17-5-18-34-53)54-35-19-6-20-36-54)48-81-68(77)60(44-73)64(55-37-21-7-22-38-55)56-39-23-8-24-40-56/h1-40H,45-48H2
InChIKey
CVSXFBFIOUYODT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Propenoic acid, 2-cyano-3,3-diphenyl-2,2-bis(((2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxy)methyl)-1,3-propanediyl ester
CAS: 178671-58-4
CID: 16134382
Formula: C69H48N4O8
MW: 1061.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1061.1
XLogP315.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count12
Rotatable Bond Count24
Exact Mass1060.34721450
Monoisotopic Mass1060.34721450
Topological Polar Surface Area200 Ų
Heavy Atom Count81
Formal Charge0
Complexity2070
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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