Phloroisobutyrophenone - CAS 35458-21-0
Catalog: |
BB058382 |
Product Name: |
Phloroisobutyrophenone |
CAS: |
35458-21-0 |
Synonyms: |
2-Methyl-1-(2,4,6-trihydroxyphenyl)-1-propanone;(2-Methylpropionyl)phloroglucinol;1-(2,4,6-Trihydroxyphenyl)-2-methylpropanone;2,4,6-Trihydroxyisobutyrophenone;2',4',6'-Trihydroxyisobutyrophenone;Isobutanoylphloroglucinol;Isobutyrylphloroglucinol;Phlorisobutyrophenone |
IUPAC Name: | 2-methyl-1-(2,4,6-trihydroxyphenyl)propan-1-one |
Description: | Phloroisobutyrophenone is an intermediate in the synthesis of Colupulone (C214755), which has antiradical and antioxidant activity. |
Molecular Weight: | 196.2 |
Molecular Formula: | C10H12O4 |
Canonical SMILES: | CC(C)C(=O)C1=C(C=C(C=C1O)O)O |
InChI: | InChI=1S/C10H12O4/c1-5(2)10(14)9-7(12)3-6(11)4-8(9)13/h3-5,11-13H,1-2H3 |
InChI Key: | BNEBXEZRBLYBCZ-UHFFFAOYSA-N |
References: | Kontek, B., et al. Industrial Crops and Products, 161, 113208 (2021). |
Complexity: | 202 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.07355886 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.07355886 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 77.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
-
Catalog: BB054889
(+)-(2S,5R)-1-Allyl-2,5-dimethylpiperazine, (+)-Camphoric Acid Salt
Detail
-
Catalog: BB059904
(-)-Methyl (3S)-3,5-Bis-{[tert-butyldimethylsilyl)oxy]}-2,2-dimethylpentanoate
Detail
-
Catalog: BB069173
((1-Chloro-2-methylpropan-2-yl)oxy)trimethylsilane
Detail
-
Catalog: BB067784
((1R,2R)-2-(2,3-Dihydrobenzofuran-4-yl)cyclopropyl)methanamine
Detail
-
Catalog: BB068424
(-)-O,O'-Dibenzylcoclaurine Hydrochloride
Detail
-
Catalog: BB064634
(+)-1-(9-Fluorenyl)ethanol
Detail
-
Catalog: BB069468
(+)-(S,S,S)-Ciramadol
Detail
-
Catalog: BB056058
(+)-(1R,2R,5R)--Ethyl [(2-Hydroxypinan-3-ylene)amino]acetate
Detail
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Other Building Blocks
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS