Cas no 345911-44-6 (Methanone,(4-ethynylphenyl)-4-pyridinyl-)
345911-44-6 structure
Product Name:Methanone,(4-ethynylphenyl)-4-pyridinyl-
CAS No:345911-44-6
MF:C14H9NO
MW:207.227363348007
CID:302621
PubChem ID:53420782
Update Time:2025-04-19
Methanone,(4-ethynylphenyl)-4-pyridinyl- Chemical and Physical Properties
Names and Identifiers
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- Methanone,(4-ethynylphenyl)-4-pyridinyl-
- (4-ethynylphenyl)-pyridin-4-ylmethanone
- 345911-44-6
- DTXSID60697677
- (4-Ethynylphenyl)(pyridin-4-yl)methanone
- FT-0604767
- (4-ETHYNYLPHENYL)-4-PYRIDINYLMETHANONE
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- Inchi： 1S/C14H9NO/c1-2-11-3-5-12(6-4-11)14(16)13-7-9-15-10-8-13/h1,3-10H
- InChI Key： RFEAOVKLLMIOOK-UHFFFAOYSA-N
- SMILES： O=C(C1C=CN=CC=1)C1C=CC(C#C)=CC=1
Computed Properties
- Exact Mass: 207.06847
- Monoisotopic Mass: 207.068
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 287
- 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: 2.4
- Topological Polar Surface Area: 30A^2
Experimental Properties
- Refractive Index: 1.619
- PSA: 29.96
Methanone,(4-ethynylphenyl)-4-pyridinyl- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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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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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Jason Wan Lab Chip, 2020,20, 4528-4538
345911-44-6 (Methanone,(4-ethynylphenyl)-4-pyridinyl-) Related Products
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