Cas no 188409-06-5 (3-Furanmethanol,4-ethynyl-2-methyl-)
188409-06-5 structure
Product Name:3-Furanmethanol,4-ethynyl-2-methyl-
CAS No:188409-06-5
MF:C8H8O2
MW:136.147922515869
CID:115270
Update Time:2024-01-24
3-Furanmethanol,4-ethynyl-2-methyl- Chemical and Physical Properties
Names and Identifiers
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- 3-Furanmethanol,4-ethynyl-2-methyl-
- 3-Furanmethanol, 4-ethynyl-2-methyl- (9CI)
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- Inchi： 1S/C8H8O2/c1-3-7-5-10-6(2)8(7)4-9/h1,5,9H,4H2,2H3
- InChI Key： VJTRCEGJPHSEPN-UHFFFAOYSA-N
- SMILES： O1C=C(C#C)C(CO)=C1C
Computed Properties
- Exact Mass: 136.05244
- Monoisotopic Mass: 136.052
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 156
- 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
- Topological Polar Surface Area: 33.4A^2
Experimental Properties
- PSA: 33.37
3-Furanmethanol,4-ethynyl-2-methyl- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
188409-06-5 (3-Furanmethanol,4-ethynyl-2-methyl-) Related Products
- 14920-89-9(2,3-Dimethylfuran)
- 6947-94-0(2-Methylfuran-3-carboxylic acid)
- 108124-17-0(2-Methyl-5-phenyl-3-furoic Acid)
- 52480-43-0(4,5-Dimethyl-2-furaldehyde)
- 132332-04-8(Ethanone,1-[4-(hydroxymethyl)-5-methyl-2-furanyl]-)
- 4412-96-8(3-Methyl-2-furoic Acid)
- 6141-58-8(Methyl 2-methyl-3-furoate)
- 38422-62-7(5-tert-Butyl-2-methylfuran-3-carboxylic Acid)
- 4412-91-3(3-Furanmethanol)
- 125309-45-7(3-Furancarboxamide,N-hydroxy-2,5-dimethyl-)
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