Cas no 83365-90-6 (4-Hydroxy-2-(phenoxymethyl)butyl prop-2-enoate)
83365-90-6 structure
Product Name:4-Hydroxy-2-(phenoxymethyl)butyl prop-2-enoate
CAS No:83365-90-6
MF:C14H18O4
MW:250.290324687958
CID:2804449
PubChem ID:66721062
Update Time:2025-04-21
4-Hydroxy-2-(phenoxymethyl)butyl prop-2-enoate Chemical and Physical Properties
Names and Identifiers
-
- 4-HYDROXY-2-(PHENOXYMETHYL)BUTYL PROP-2-ENOATE
- SCHEMBL544766
- DTXSID90735637
- 83365-90-6
- 4-Hydroxy-2-(phenoxymethyl)butyl prop-2-enoate
-
- Inchi： 1S/C14H18O4/c1-2-14(16)18-11-12(8-9-15)10-17-13-6-4-3-5-7-13/h2-7,12,15H,1,8-11H2
- InChI Key： DGFNCAPDQKYQJV-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)CC(COC(C=C)=O)CCO
Computed Properties
- Exact Mass: 250.12050905Da
- Monoisotopic Mass: 250.12050905Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 246
- 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: 2.3
- Topological Polar Surface Area: 55.8?2
4-Hydroxy-2-(phenoxymethyl)butyl prop-2-enoate Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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2. 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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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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