Cas no 70150-60-6 (2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)-)
70150-60-6 structure
Product Name:2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)-
CAS No:70150-60-6
MF:C13H16O3
MW:220.264344215393
CID:547631
PubChem ID:53663924
Update Time:2025-04-19
2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)-
- ethyl 4-phenylmethoxybut-2-enoate
- 4-Benzyloxy-but-2-enoic acid ethyl ester
- DTXSID40705784
- 70150-60-6
- AVFZSZKFMFOGQL-UHFFFAOYSA-N
- Ethyl 4-(benzyloxy)but-2-enoate
-
- Inchi： 1S/C13H16O3/c1-2-16-13(14)9-6-10-15-11-12-7-4-3-5-8-12/h3-9H,2,10-11H2,1H3
- InChI Key： AVFZSZKFMFOGQL-UHFFFAOYSA-N
- SMILES： O(CC=CC(=O)OCC)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 220.10998
- Monoisotopic Mass: 220.11
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 217
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.1
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)- Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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3. 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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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
70150-60-6 (2-Butenoic acid, 4-(phenylmethoxy)-, ethyl ester, (2E)-) Related Products
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