Cas no 55160-68-4 (Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester)
55160-68-4 structure
Product Name:Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester
CAS No:55160-68-4
MF:C13H16O4
MW:236.263744354248
CID:352692
PubChem ID:14025141
Update Time:2025-04-19
Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester
- 2-(Benzyloxy)ethyl 3-oxobutanoate
- acetoacetic acid 2-benzyloxyethyl ester
- 55160-68-4
- 2-benzyloxyethyl acetoacetate
- USXVZDHUZYAHJQ-UHFFFAOYSA-N
- SCHEMBL7382600
- DTXSID10554504
-
- Inchi： 1S/C13H16O4/c1-11(14)9-13(15)17-8-7-16-10-12-5-3-2-4-6-12/h2-6H,7-10H2,1H3
- InChI Key： USXVZDHUZYAHJQ-UHFFFAOYSA-N
- SMILES： O(CCOC(CC(C)=O)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 236.10488
- Monoisotopic Mass: 236.10485899g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 8
- Complexity: 244
- 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: 52.6?2
Experimental Properties
- PSA: 52.6
Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester 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
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
55160-68-4 (Butanoic acid, 3-oxo-, 2-(phenylmethoxy)ethyl ester) Related Products
- 103-40-2(Succinic Acid Monobenzyl Ester)
- 6939-75-9(Pentanoic acid, 4-oxo-,phenylmethyl ester)
- 103-43-5(dibenzyl succinate)
- 91970-62-6(4-Hydroxybutyric Acid Benzyl Ester)
- 5396-89-4(Benzyl acetoacetate)
- 103-37-7(Benzyl butyrate)
- 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)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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