Cas no 38791-02-5 (Methanone, 3-isoxazolylphenyl-)
38791-02-5 structure
Product Name:Methanone, 3-isoxazolylphenyl-
CAS No:38791-02-5
MF:C10H7NO2
MW:173.168082475662
CID:1491359
PubChem ID:13126988
Update Time:2025-04-21
Methanone, 3-isoxazolylphenyl- Chemical and Physical Properties
Names and Identifiers
-
- Methanone, 3-isoxazolylphenyl-
- Isoxazol-3-yl(phenyl)methanone
- 38791-02-5
- benzoylisoxazole
- SCHEMBL168602
- A1-46026
-
- Inchi： 1S/C10H7NO2/c12-10(9-6-7-13-11-9)8-4-2-1-3-5-8/h1-7H
- InChI Key： XBYZOHTXPQOOJM-UHFFFAOYSA-N
- SMILES： O1C=CC(C(C2C=CC=CC=2)=O)=N1
Computed Properties
- Exact Mass: 173.04771
- Monoisotopic Mass: 173.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 187
- 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
- Topological Polar Surface Area: 43.1?2
Experimental Properties
- PSA: 43.1
Methanone, 3-isoxazolylphenyl- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM519446-1g |
Isoxazol-3-yl(phenyl)methanone |
38791-02-5 | 97% | 1g |
$670 | 2023-01-07 |
Methanone, 3-isoxazolylphenyl- Related Literature
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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