Cas no 13021-52-8 (1-butoxy-3-ethoxypropan-2-ol)
1-butoxy-3-ethoxypropan-2-ol structure
Product Name:1-butoxy-3-ethoxypropan-2-ol
CAS No:13021-52-8
MF:C9H20O3
MW:176.253303527832
CID:1225659
PubChem ID:9920513
Update Time:2025-04-20
1-butoxy-3-ethoxypropan-2-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-butoxy-3-ethoxypropan-2-ol
- 2-propanol, 1-butoxy-3-ethoxy-
- DTXSID50432796
- 13021-52-8
- SCHEMBL4126553
-
- Inchi： 1S/C9H20O3/c1-3-5-6-12-8-9(10)7-11-4-2/h9-10H,3-8H2,1-2H3
- InChI Key： UXQUQIDOQQLAOV-UHFFFAOYSA-N
- SMILES： O(CCCC)CC(COCC)O
Computed Properties
- Exact Mass: 176.1413
- Monoisotopic Mass: 176.14124450g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 8
- Complexity: 85.8
- 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: 1.3
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.69
1-butoxy-3-ethoxypropan-2-ol Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
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
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
13021-52-8 (1-butoxy-3-ethoxypropan-2-ol) Related Products
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- 544-62-7(Batyl alcohol)
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- 10550-58-0(3-O-Hexadecyl-sn-glycerol)
- 2426-08-6(Butyl glycidyl ether)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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