Uvinul 3030

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

CAS No.: 178671-58-4

Molecular Weight：1061.14

Modify Date.: 2022-11-25 10:46

Request For Quotation

1. Names and Identifiers

1.1 Name: Uvinul 3030
1.2 Synonyms: 1,1′-[2,2-Bis[[(2-cyano-1-oxo-3,3-diphenyl-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] bis(2-cyano-3,3-diphenyl-2-propenoate) 1,3-Bis[(2′-cyano-3′,3′-diphenylacryloyl)oxy]-2,2-bis-[(2′-cyano-3′,3′-diphenylacryloyl)oxy]methyl]propane 1,3-Bis-[(2'-cyano-3',3'-diphenylacryloyl)oxy]-2,2-bis-[[(2'-cyano-3',3'-diphenylacryloyl)oxy]methyl]propane 1,3-Bis[(2-cyano-3,3-diphenylacryloyl)oxy]-2,2-bis[[(2-cyano-3,3-diphenylacryloyl)oxy]methyl]propane 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)-propane-1,3-diyl bis(2-cyano-3,3-diphenylacryl 2,2-Bis(((2-cyano-3,3-diphenylacryloyl)oxy)methyl)propane-1,3-diyl bis(2-cyano-3,3-diphenylacrylate) 2-Cyano-3,3-diphenyl-2-propenoic acid, 2,2-bis[[(2-cyano-1-oxo-3,3 -diphenyl-2-propenyl)oxy]methyl]-1,3-propanediyl ester 2-Propenoic acid, 2-cyano-3,3-diphenyl-, 1,1′-[2,2-bis[[(2-cyano-1-oxo-3,3-diphenyl-2-propen-1-yl)oxy]methyl]-1,3-propanediyl] ester 2-Propenoic acid, 2-cyano-3,3-diphenyl-, 2,2-bis(2-cyano-1-oxo-3,3-diphenyl-2-propenyl)oxymethyl-1,3-propanediyl ester 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 Pentaerythritol tetrakis(2-cyano-3,3-diphenylacrylate) / UV3030 PENTAERYTHRITOLTETRAKIS(2-CYANO-3,3-DIPHENYLACRYLATE) UV 3030 UV3030 Uvinul 3030 Uvinul 3030-12

1.3 CAS No.: 178671-58-4

1.4 CID: 16134382

1.5 EINECS(EC#): 924-350-7

1.6 Molecular Formula: C69H48N4O8 (isomer)

1.7 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

1.8 InChkey: CVSXFBFIOUYODT-UHFFFAOYSA-N

1.9 Canonical 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

1.10 Isomers 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

2. Properties

2.1 Density: 1.268

2.1 Boiling point: 1077.363 °C at 760 mmHg

2.1 Refractive index: 1.642

2.1 Flash Point: 418.445 °C

2.1 Precise Quality: 1031.34000

2.1 PSA: 191.13000

2.1 logP: 12.39720

3. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)	No symbol.
Signal word	No signal word.
Hazard statement(s)	H413 May cause long lasting harmful effects to aquatic life
Precautionary statement(s)
Prevention	P273 Avoid release to the environment.
Response	none
Storage	none
Disposal	P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

View all

4. NMR Spectrum

13C NMR : Predict

1H NMR : Predict

5. Computational chemical data

Molecular Weight: 1061.14g/mol
Molecular Formula: C₆₉H₄₈N₄O₈
Compound Is Canonicalized: True
XLogP3-AA: 15.5
Exact Mass: 1060.34721450
Monoisotopic Mass: 1060.34721450
Complexity: 2070
Rotatable Bond Count: 24
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 12
Topological Polar Surface Area: 200
Heavy Atom Count: 81
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADcfB/vAAAAAAAAAAAAAAAAAAAAAAAAAAwYMGDAAAAAAABVAAAHgAAAAAADgChmAIwCIAABACYBiDSCAAiAAAgAAAIiAEAAMgIpCKAMRCCMAAhgAAIqQcAgMAOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

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7. Realated Product Infomation

124172-53-8 Uvinul 4050 H

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