Cas no 45966-02-7 (Phenol, 4-(3-buten-1-ynyl)-)
Phenol, 4-(3-buten-1-ynyl)- structure
Product Name:Phenol, 4-(3-buten-1-ynyl)-
CAS No:45966-02-7
MF:C10H8O
MW:144.169922828674
CID:324144
PubChem ID:71362981
Update Time:2025-04-19
Phenol, 4-(3-buten-1-ynyl)- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-(3-buten-1-ynyl)-
- 4-but-3-en-1-ynylphenol
- 4-(But-3-en-1-yn-1-yl)phenol
- DTXSID20786576
- SCHEMBL7035142
- 45966-02-7
-
- Inchi： 1S/C10H8O/c1-2-3-4-9-5-7-10(11)8-6-9/h2,5-8,11H,1H2
- InChI Key： ZHFFALGLSCREJF-UHFFFAOYSA-N
- SMILES： OC1C=CC(C#CC=C)=CC=1
Computed Properties
- Exact Mass: 144.057514874g/mol
- Monoisotopic Mass: 144.057514874g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 185
- 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: 2.7
- Topological Polar Surface Area: 20.2?2
Phenol, 4-(3-buten-1-ynyl)- Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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