3-Hydroxy-2,2-dimethyl-1-indanone - CAS 59269-93-1
Catalog: |
BB030321 |
Product Name: |
3-Hydroxy-2,2-dimethyl-1-indanone |
CAS: |
59269-93-1 |
Synonyms: |
3-hydroxy-2,2-dimethyl-3H-inden-1-one; 3-hydroxy-2,2-dimethyl-3H-inden-1-one |
IUPAC Name: | 3-hydroxy-2,2-dimethyl-3H-inden-1-one |
Description: | 3-Hydroxy-2,2-dimethyl-1-indanone (CAS# 59269-93-1 ) is a useful research chemical. |
Molecular Weight: | 176.21 |
Molecular Formula: | C11H12O2 |
Canonical SMILES: | CC1(C(C2=CC=CC=C2C1=O)O)C |
InChI: | InChI=1S/C11H12O2/c1-11(2)9(12)7-5-3-4-6-8(7)10(11)13/h3-6,9,12H,1-2H3 |
InChI Key: | YATVHPCKCBERKE-UHFFFAOYSA-N |
LogP: | 1.94250 |
Publication Number | Title | Priority Date |
AU-2007334416-A1 | Imidazoles as aldosterone synthase inhibitors | 20061218 |
CA-2672269-A1 | Organic compounds | 20061218 |
CN-101605777-A | Glyoxaline compound as aldosterone synthase inhibitors | 20061218 |
EP-2094680-A2 | Imidazoles as aldosterone synthase inhibitors | 20061218 |
EP-2213668-A2 | Imidazoles as aldosterone synthase inhibitors | 20061218 |
Complexity: | 232 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.083729621 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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