Cas no 113778-34-0 (3-Phenylpropyl Acetoacetate)
3-Phenylpropyl Acetoacetate structure
Product Name:3-Phenylpropyl Acetoacetate
CAS No:113778-34-0
MF:C13H16O3
MW:220.264344215393
CID:1201964
PubChem ID:11074912
Update Time:2025-04-20
3-Phenylpropyl Acetoacetate Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 3-oxo-, 3-phenylpropyl ester
- 113778-34-0
- 3-Phenylpropyl 3-Oxobutanoate; 3-Oxo-butanoic Acid 3-Phenylpropyl Ester;
- Benzylacetessigester
- SCHEMBL7629438
- XPOCLMJKMPFRAM-UHFFFAOYSA-N
- 3-phenylpropyl acetoacetate
- 3-PhenylpropylAcetoacetate
- 3-Phenylpropyl Acetoacetate
-
- Inchi： 1S/C13H16O3/c1-11(14)10-13(15)16-9-5-8-12-6-3-2-4-7-12/h2-4,6-7H,5,8-10H2,1H3
- InChI Key： XPOCLMJKMPFRAM-UHFFFAOYSA-N
- SMILES： O(C(CC(C)=O)=O)CCCC1C=CC=CC=1
Computed Properties
- Exact Mass: 220.10998
- Monoisotopic Mass: 220.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 7
- Complexity: 229
- 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: 2.4
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
3-Phenylpropyl Acetoacetate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | P336340-2.5mg |
3-Phenylpropyl Acetoacetate |
113778-34-0 | 2.5mg |
$ 115.00 | 2023-09-06 | ||
| TRC | P336340-5mg |
3-Phenylpropyl Acetoacetate |
113778-34-0 | 5mg |
$ 190.00 | 2023-09-06 | ||
| TRC | P336340-10mg |
3-Phenylpropyl Acetoacetate |
113778-34-0 | 10mg |
$ 351.00 | 2023-09-06 | ||
| TRC | P336340-25mg |
3-Phenylpropyl Acetoacetate |
113778-34-0 | 25mg |
$850.00 | 2023-05-17 | ||
| TRC | P336340-50mg |
3-Phenylpropyl Acetoacetate |
113778-34-0 | 50mg |
$1458.00 | 2023-05-17 |
3-Phenylpropyl Acetoacetate Related Literature
-
Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
-
P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
113778-34-0 (3-Phenylpropyl Acetoacetate) Related Products
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