Cas no 96573-37-4 (Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)-)
96573-37-4 structure
Product Name:Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)-
CAS No:96573-37-4
MF:C11H12O5
MW:224.209983825684
CID:751385
PubChem ID:11622690
Update Time:2025-04-19
Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)-
- 2,4,6-trihydroxy-3-methyl-5-propanoylbenzaldehyde
- CHEMBL224944
- 2,4,6-trihydroxy-3-methyl-5-propanoyl-benzaldehyde
- 96573-37-4
- DTXSID00469597
- 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)benzaldehyde
-
- Inchi： 1S/C11H12O5/c1-3-7(13)8-10(15)5(2)9(14)6(4-12)11(8)16/h4,14-16H,3H2,1-2H3
- InChI Key： MMQZHVUMLYIZRL-UHFFFAOYSA-N
- SMILES： OC1C(C)=C(C(C=O)=C(C=1C(CC)=O)O)O
Computed Properties
- Exact Mass: 224.06847348g/mol
- Monoisotopic Mass: 224.06847348g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 278
- 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: 1.9
- Topological Polar Surface Area: 94.8?2
Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)- Related Literature
-
Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
-
Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
-
L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
-
Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
96573-37-4 (Benzaldehyde, 2,4,6-trihydroxy-3-methyl-5-(1-oxopropyl)-) Related Products
- 2295-58-1(Flopropione)
- 2887-61-8(2'-Hydroxybutyrophenone)
- 610-99-1(2'-Hydroxypropiophenone)
- 4390-92-5(1-(2,4-Dihydroxyphenyl)butan-1-one)
- 3516-95-8(2’-Hydroxy-3-phenylpropiophenone)
- 89-84-9(2',4'-Dihydroxyacetophenone)
- 699-83-2(2',6'-Dihydroxyacetophenone)
- 5792-36-9(2',4'-Dihydroxypropiophenone)
- 3144-54-5(1-(2,4-Dihydroxyphenyl)-1-hexanone)
- 480-66-0(Phloracetophenone)
Recommended suppliers
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
HANGZHOU BAIS CHEMICAL TECHNOLOGY CO., LTD.
Gold Member
Audited Supplier
CN Supplier
Reagent
Hubei Cuiyuan Biotechnology Co.,Ltd
Gold Member
Audited Supplier
CN Supplier
Reagent
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier
CN Supplier
Bulk
煙臺朗裕新材料科技有限公司
Gold Member
Audited Supplier
CN Supplier
Reagent