Cas no 123926-55-6 (1-Penten-4-yn-3-ol,5-(1-methylcyclopropyl)-)
123926-55-6 structure
Product Name:1-Penten-4-yn-3-ol,5-(1-methylcyclopropyl)-
CAS No:123926-55-6
MF:C9H12O
MW:136.190982818604
CID:103957
PubChem ID:19744743
Update Time:2025-04-18
1-Penten-4-yn-3-ol,5-(1-methylcyclopropyl)- Chemical and Physical Properties
Names and Identifiers
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- 1-Penten-4-yn-3-ol,5-(1-methylcyclopropyl)-
- 1-Penten-4-yn-3-ol, 5-(1-methylcyclopropyl)- (9CI)
- 5-(1-methylcyclopropyl)pent-1-en-4-yn-3-ol
- SCHEMBL9454063
- 123926-55-6
-
- Inchi： 1S/C9H12O/c1-3-8(10)4-5-9(2)6-7-9/h3,8,10H,1,6-7H2,2H3
- InChI Key： UVMSQOZKBGQDDJ-UHFFFAOYSA-N
- SMILES： OC(C=C)C#CC1(C)CC1
Computed Properties
- Exact Mass: 136.08886
- Monoisotopic Mass: 136.088815002g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 199
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.1
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
1-Penten-4-yn-3-ol,5-(1-methylcyclopropyl)- Related Literature
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1. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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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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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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