Cas no 14635-91-7 (Benzene, 1-methyl-3-(phenylethynyl)-)
14635-91-7 structure
Product Name:Benzene, 1-methyl-3-(phenylethynyl)-
CAS No:14635-91-7
MF:C15H12
MW:192.255784034729
CID:1317360
PubChem ID:10987106
Update Time:2025-04-20
Benzene, 1-methyl-3-(phenylethynyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-methyl-3-(phenylethynyl)-
- 1-methyl-3-(2-phenylethynyl)benzene
- 14635-91-7
- DTXSID20450846
- Benzene, 1-methyl-3-(2-phenylethynyl)-
- 1-Methyl-3-(phenylethynyl)benzene
- 1-Methyl-3-phenylethynyl-benzene
- HS-4505
- (3-Methylphenyl)phenylacetylene
-
- Inchi： 1S/C15H12/c1-13-6-5-9-15(12-13)11-10-14-7-3-2-4-8-14/h2-9,12H,1H3
- InChI Key： CREZZKUDBMAYFS-UHFFFAOYSA-N
- SMILES： C1(C)C=CC=C(C#CC2C=CC=CC=2)C=1
Computed Properties
- Exact Mass: 192.09396
- Monoisotopic Mass: 192.093900383g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 246
- 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: 5.1
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1-methyl-3-(phenylethynyl)- Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
14635-91-7 (Benzene, 1-methyl-3-(phenylethynyl)-) Related Products
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- 92866-00-7(1-Ethynyl-4-(phenylethynyl)benzene)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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