Cas no 51624-43-2 (Benzene, 1-chloro-4-(4-phenyl-1,3-butadiynyl)-)
51624-43-2 structure
Product Name:Benzene, 1-chloro-4-(4-phenyl-1,3-butadiynyl)-
CAS No:51624-43-2
MF:C16H9Cl
MW:236.69566321373
CID:361834
PubChem ID:13718166
Update Time:2025-04-19
Benzene, 1-chloro-4-(4-phenyl-1,3-butadiynyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzene, 1-chloro-4-(4-phenyl-1,3-butadiynyl)-
- 1-chloro-4-(4-phenylbuta-1,3-diynyl)benzene
- DTXSID90547510
- 51624-43-2
- 1-Chloro-4-(4-phenylbuta-1,3-diyn-1-yl)benzene
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- Inchi: 1S/C16H9Cl/c17-16-12-10-15(11-13-16)9-5-4-8-14-6-2-1-3-7-14/h1-3,6-7,10-13H
- InChI Key: ZZMVTEJGTRRGOQ-UHFFFAOYSA-N
- SMILES: ClC1C=CC(C#CC#CC2C=CC=CC=2)=CC=1
Computed Properties
- Exact Mass: 236.03937
- Monoisotopic Mass: 236.0392780g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 355
- 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: 5.4
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1-chloro-4-(4-phenyl-1,3-butadiynyl)- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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