6-Hydroxy-1-indanone - CAS 62803-47-8
Catalog: |
BB031811 |
Product Name: |
6-Hydroxy-1-indanone |
CAS: |
62803-47-8 |
Synonyms: |
1H-Inden-1-one, 2,3-dihydro-6-hydroxy-; 1-Indanone, 6-hydroxy-; 2,3-Dihydro-6-hydroxy-1H-inden-1-one; 6-Hydroxy-2,3-dihydro-1H-inden-1-one; 6-Hydroxyindan-1-one |
IUPAC Name: | 6-hydroxy-2,3-dihydroinden-1-one |
Molecular Weight: | 148.16 |
Molecular Formula: | C9H8O2 |
Canonical SMILES: | C1CC(=O)C2=C1C=CC(=C2)O |
InChI: | InChI=1S/C9H8O2/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,10H,2,4H2 |
InChI Key: | MOANRQDXNNXOLW-UHFFFAOYSA-N |
Boiling Point: | 329.0±31.0°C at 760 mmHg |
Melting Point: | 152°C |
Purity: | ≥95% |
Density: | 1.305±0.06 g/cm3 |
Solubility: | Soluble in Methanol |
Appearance: | Light Yellow to Amber to Dark Green Powder to Crystal |
Storage: | Store at RT |
MDL: | MFCD00513530 |
LogP: | 1.52110 |
GHS Hazard Statement: | H302 (97.62%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021299666-A1 | Systems and methods for synthesizing a reaction product and increasing yield of the same | 20200325 |
US-2021252170-A1 | Targeted contrast agents for mri of alpha-synuclein deposition | 20200212 |
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PMID | Publication Date | Title | Journal |
22219927 | 20111101 | 1-[3-(4-Nitro-phen-yl)propano-yl]urea acetic acid monosolvate | Acta crystallographica. Section E, Structure reports online |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 148.052429494 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 148.052429494 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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