Cas no 499138-96-4 (Pentacene, 2,3,9,10-tetramethyl-)
499138-96-4 structure
Product Name:Pentacene, 2,3,9,10-tetramethyl-
CAS No:499138-96-4
MF:C26H22
MW:334.452887058258
CID:1539087
PubChem ID:5246912
Update Time:2025-04-21
Pentacene, 2,3,9,10-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- Pentacene, 2,3,9,10-tetramethyl-
- 2,3,9,10-tetramethylpentacene
- 499138-96-4
- DTXSID00413010
-
- Inchi： 1S/C26H22/c1-15-5-19-9-23-13-25-11-21-7-17(3)18(4)8-22(21)12-26(25)14-24(23)10-20(19)6-16(15)2/h5-14H,1-4H3
- InChI Key： BMULTRODJUCQMI-UHFFFAOYSA-N
- SMILES： C12C=C3C=C(C)C(C)=CC3=CC1=CC1C=C3C=C(C)C(C)=CC3=CC=1C=2
Computed Properties
- Exact Mass: 334.17226
- Monoisotopic Mass: 334.172150702g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 26
- Rotatable Bond Count: 0
- Complexity: 418
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8.4
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Pentacene, 2,3,9,10-tetramethyl- Related Literature
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
499138-96-4 (Pentacene, 2,3,9,10-tetramethyl-) Related Products
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- 146448-88-6(Phenanthrene,1,2,9-trimethyl-)
- 2131-43-3(1,2,5,6-Tetramethylnaphthalene)
- 2245-38-7(1,6,7-Trimethylnaphthalene)
- 15679-25-1(Pyrene, 4,5-dimethyl-)
- 581-40-8(2,3-Dimethylnaphthalene)
- 2717-42-2(Naphthalene,1,2,4-trimethyl-)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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