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CAS No.: | 28315-93-7 |
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Name: | 5-Hydroxy-1-tetralone |
Article Data: | 21 |
Cas Database | |
Molecular Structure: | |
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Formula: | C10H10O2 |
Molecular Weight: | 162.188 |
Synonyms: | 1,2,3,4-Tetrahydro-1-oxo-5-hydroxynaphthalene;3,4-Dihydro-5-hydroxy-1(2H)-naphthalenone;5-Hydroxy-3,4-dihydro-1(2H)-naphthalenone;5-Hydroxy-a-tetralone;5-Hydroxytetralone;5-Hydroxy-1-tetralone; |
EINECS: | 248-958-0 |
Density: | 1.236 g/cm3 |
Melting Point: | 206-209 °C(lit.) |
Boiling Point: | 325.3 °C at 760 mmHg |
Flash Point: | 138.1 °C |
Appearance: | yellowish crystalline powder |
Hazard Symbols: |
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Risk Codes: | 36/37/38 |
Safety: | 22-24/25-37/39-26 |
PSA: | 37.30000 |
LogP: | 1.91120 |
1,2,3,4-tetrahydro-1,5-dihydroxy-naphthalene
5-Hydroxy-1-tetralone
Conditions | Yield |
---|---|
With tert.-butylhydroperoxide; zircornium(IV) n-propoxide In dichloromethane at 20℃; for 18h; | 96% |
1,5-dihydroxynaphthalene
5-Hydroxy-1-tetralone
Conditions | Yield |
---|---|
With aluminum tri-bromide; cyclohexane In various solvent(s) at 25℃; for 48h; | 88% |
With palladium on activated charcoal; ammonium formate In water; butan-1-ol at 120℃; for 3h; Temperature; Solvent; Reagent/catalyst; Further stages; | 83.3% |
Stage #1: 1,5-dihydroxynaphthalene With hydrogen; sodium hydroxide; palladium 10% on activated carbon In water; isopropyl alcohol at 20 - 80℃; under 5171.62 Torr; Autoclave; Stage #2: With hydrogenchloride In water pH=~ 2; | 60% |
Stage #1: 1,5-dihydroxynaphthalene With hydrogen; sodium hydroxide; palladium 10% on activated carbon In water; isopropyl alcohol at 80℃; under 5171.62 Torr; for 20h; Autoclave; Stage #2: With hydrogenchloride In water pH=~ 2; | 60% |
With palladium 10% on activated carbon; hydrogen; sodium hydroxide In water; isopropyl alcohol at 80℃; under 8250.83 Torr; for 24h; Autoclave; | 53% |
5-Methoxy-1-tetralone
5-Hydroxy-1-tetralone
Conditions | Yield |
---|---|
With hydrogen bromide; acetic acid for 0.75h; Heating; | 85% |
With 1-N-ferrocenylmethyl benzimidazole tagged polymer In N,N-dimethyl-formamide Reflux; | 82% |
With hydrogen bromide In acetic acid for 24h; Heating; |
4,5-dihydro-3H-benzo[b]oxepin-2-one
A
2-hydroxybenzenebutanoic acid
B
5-Hydroxy-1-tetralone
Conditions | Yield |
---|---|
With PPA at 80℃; for 3h; | A 55% B 7% |
2-allyl-3-hydroxy-benzaldehyde
A
5-Hydroxy-1-tetralone
B
4-hydroxy-2-methyl-2,3-dihydro-1H-inden-1-one
Conditions | Yield |
---|---|
With acetic acid; L-proline at 120℃; for 24h; Green chemistry; | A 40% B 42% |
3,4-dihydronaphthalene-1(2H)-one
A
7-hydroxy-1-tetralone
B
5-Hydroxy-1-tetralone
C
5,8-dihydroxy-1-tetralone
Conditions | Yield |
---|---|
With dihydrogen peroxide; hydrogen fluoride; antimony pentafluoride at -40℃; for 0.5h; Mechanism; Product distribution; | A 30% B 34% C 5% |
With dihydrogen peroxide; hydrogen fluoride; antimony pentafluoride at -40℃; for 0.5h; | A 30% B 34% C 5% |
5,6,7,8-tetrahydronaphthalen-1-yl acetate
5-Hydroxy-1-tetralone
Conditions | Yield |
---|---|
With chromium(VI) oxide; acetic anhydride; acetic acid at 40℃; und Erhitzen des erhaltenen 5-Acetoxy-1-oxo-tetralins C12H12O3 mit wss.-aethanol.NaOH unter Wasserstoff; substances of mp: about 210 degree; |
(4aSR,8aSR)-octahydronaphthalene-1,5-dione
5-Hydroxy-1-tetralone
Conditions | Yield |
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With potassium hydroxide substances of mp: 157 degree; |
5-Hydroxy-1-tetralone
Conditions | Yield |
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With sulfuric acid Diazotization; substances of mp: about 210 degree; |
5-Hydroxy-1-tetralone
Conditions | Yield |
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With kieselguhr; tetralin; nickel at 120 - 180℃; under 7355.08 - 14710.2 Torr; Hydrogenation; substances of mp: 157 degree; |
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HPLC(FDA Method)
1.Introduction of 5-Hydroxy-1-tetralone
5-Hydroxy-1-tetralone,with its CAS NO of 28315-93-7, is a kind of white to off-white powder. It has synonyms of 1,2,3,4-Tetrahydro-1-oxo-5-hydroxynaphthalene;3,4-Dihydro-5-hydroxy-1(2H)-naphthalenone;5-Hydroxy-3,4-dihydro-1(2H)-naphthalenone;5-Hydroxy-a-tetralone and 5-Hydroxytetralone. It is stable under normal temperatures and pressures.
2.Properties of 5-Hydroxy-1-tetralone
Surface Tension: 52.4 dyne/cmIndex of Refraction: 1.602Density: 1.236 g/cm3Flash Point: 138.1 °CEnthalpy of Vaporization: 59 kJ/molBoiling Point: 325.3 °C at 760 mmHgVapour Pressure: 0.000122 mmHg at 25 °C
3.Structure Descriptors of 5-Hydroxy-1-tetralone
SMILES:O=C2c1cccc(O)c1CCC2
Std. InChI:InChI=1S/C10H10O2/c11-9-5-1-3-7-8(9)4-2-6-10(7)12/h1,3,5,11H,2,4,6H2
Std. InChIKey:YPPZCRZRQHFRBH-UHFFFAOYSA-N
4.Safety profile of 5-Hydroxy-1-tetralone
Hazard Codes:Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 22-24/25-37/39-26-36
S22:Do not breathe dust.
S24/25:Avoid contact with skin and eyes.
S37/39:Wear suitable gloves and eye/face protection.
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
5.Toxicity of 5-Hydroxy-1-tetralone
RTECS#: CAS# 28315-93-7: None listed
LD50/LC50: RTECS: Not available.
Carcinogenicity: 5-Hydroxy-1-tetralone - Not listed as a carcinogen by ACGIH, IARC, NTP, or CA Prop 65.
Other: The toxicological properties have not been fully investigated.