Cas no 1830-79-1 (2-Propenoic acid, 2-hydroxy-3-(2-propenyloxy)propyl ester)
1830-79-1 structure
Product Name:2-Propenoic acid, 2-hydroxy-3-(2-propenyloxy)propyl ester
CAS No:1830-79-1
MF:C9H14O4
MW:186.205063343048
CID:96144
PubChem ID:12424151
Update Time:2025-04-18
2-Propenoic acid, 2-hydroxy-3-(2-propenyloxy)propyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 2-hydroxy-3-(2-propenyloxy)propyl ester
- (2-hydroxy-3-prop-2-enoxypropyl) prop-2-enoate
- Acrylic acid 2-hydroxy-3-(2-propenyloxy)propyl ester
- DTXSID80497611
- 1830-79-1
- 2-Hydroxy-3-[(prop-2-en-1-yl)oxy]propyl prop-2-enoate
- SCHEMBL3410016
- GEDPWPYPHQIRJD-UHFFFAOYSA-N
-
- Inchi： 1S/C9H14O4/c1-3-5-12-6-8(10)7-13-9(11)4-2/h3-4,8,10H,1-2,5-7H2
- InChI Key： GEDPWPYPHQIRJD-UHFFFAOYSA-N
- SMILES： O(CC=C)CC(COC(C=C)=O)O
Computed Properties
- Exact Mass: 186.08922
- Monoisotopic Mass: 186.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 177
- 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: 0.6
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
2-Propenoic acid, 2-hydroxy-3-(2-propenyloxy)propyl ester Related Literature
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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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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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