Cas no 647029-25-2 (Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-)
![Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]- structure](https://ossimg.kuujia.com/scimg/647500/647029-25-2x500.png)
647029-25-2 structure
Product Name:Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-
CAS No:647029-25-2
MF:C10H12O3
MW:180.200483322144
CID:417926
PubChem ID:12033081
Update Time:2025-04-19
Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-
- 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]ethanone
- 647029-25-2
- DTXSID70476213
-
- Inchi： 1S/C10H12O3/c1-6-3-8(7(2)12)4-9(5-11)10(6)13/h3-4,11,13H,5H2,1-2H3
- InChI Key： GYZTVMUVMWMWER-UHFFFAOYSA-N
- SMILES： OC1C(C)=CC(C(C)=O)=CC=1CO
Computed Properties
- Exact Mass: 180.078644241g/mol
- Monoisotopic Mass: 180.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 191
- 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: 1.3
- Topological Polar Surface Area: 57.5?2
Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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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
647029-25-2 (Ethanone, 1-[4-hydroxy-3-(hydroxymethyl)-5-methylphenyl]-) Related Products
- 39235-58-0(1-4-Hydroxy-3-(hydroxymethyl)phenyl-ethanone)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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