Cas no 82690-38-8 (Benzenamine, 3-(4-phenyl-1,3-butadiynyl)-)
82690-38-8 structure
Product Name:Benzenamine, 3-(4-phenyl-1,3-butadiynyl)-
CAS No:82690-38-8
MF:C16H11N
MW:217.265243768692
CID:687254
PubChem ID:71417965
Update Time:2025-04-19
Benzenamine, 3-(4-phenyl-1,3-butadiynyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenamine, 3-(4-phenyl-1,3-butadiynyl)-
- 3-(4-phenylbuta-1,3-diynyl)aniline
- 3-(4-Phenylbuta-1,3-diyn-1-yl)aniline
- DTXSID60837293
- 82690-38-8
-
- Inchi： 1S/C16H11N/c17-16-12-6-11-15(13-16)10-5-4-9-14-7-2-1-3-8-14/h1-3,6-8,11-13H,17H2
- InChI Key： ZXCJPZATEVLOQN-UHFFFAOYSA-N
- SMILES： NC1C=CC=C(C#CC#CC2C=CC=CC=2)C=1
Computed Properties
- Exact Mass: 217.089149355g/mol
- Monoisotopic Mass: 217.089149355g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 363
- 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: 3.7
- Topological Polar Surface Area: 26?2
Benzenamine, 3-(4-phenyl-1,3-butadiynyl)- Related Literature
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
82690-38-8 (Benzenamine, 3-(4-phenyl-1,3-butadiynyl)-) Related Products
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