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CAS No.: | 28141-13-1 |
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Name: | 1-Ethyl-6-hydroxy-4-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C9H10N2O2 |
Molecular Weight: | 178.191 |
Synonyms: | 1-Ethyl-2-hydroxy-4-methyl-5-cyano-6-pyridinone;1-Ethyl-2-hydroxy-4-methyl-5-cyano-6-pyridone;1-Ethyl-3-cyano-4-methyl-6-hydroxy-2-pyridone;1-Ethyl-3-cyano-6-hydroxy-4-methyl-2-pyridone;3-Cyano-1-ethyl-6-hydroxy-4-methylpyrid-2-one;3-Cyano-N-ethyl-6-hydroxy-4-methyl-2-pyridone;3-Cyano-N-ethyl-6-hydroxy-4-methylpyridone; |
EINECS: | 248-865-5 |
Density: | 1.27 g/cm3 |
Melting Point: | 244-247 °C(lit.) |
Boiling Point: | 316.82 °C at 760 mmHg |
Flash Point: | 145.408 °C |
Appearance: | White powder in rice form |
Hazard Symbols: | Xn |
Risk Codes: | 20/21/22-36/37/38 |
Safety: | 26-36 |
PSA: | 66.02000 |
LogP: | 0.75388 |
ethyl acetoacetate
ethylamine
methyl 2-cyanoacetate
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
With silica gel for 0.0333333h; microwave irradiation; | 94% |
ethylamine
acetoacetic acid methyl ester
ethyl 2-cyanoacetate
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
With silica gel for 0.0333333h; microwave irradiation; | 94% |
ethyl acetoacetate
ethylamine
ethyl 2-cyanoacetate
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
With silica gel for 0.0333333h; microwave irradiation; | 93% |
ethylamine
acetoacetic acid methyl ester
methyl 2-cyanoacetate
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
With silica gel for 0.0333333h; microwave irradiation; | 93% |
In water |
4,4'-diamino-2,2'-biphenyldisulfonic acid
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
Stage #1: 4,4'-diamino-2,2'-biphenyldisulfonic acid With sodium hydroxide; sodium nitrite In water for 0.5h; pH=7 - 8; Cooling with ice; Stage #2: With hydrogenchloride In water for 2h; Stage #3: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone Further stages; | 100% |
4-(Aminophenyl)-sulfonylessigsaeure
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
Stage #1: 4-(Aminophenyl)-sulfonylessigsaeure With hydrogenchloride; sodium nitrite In water at -5 - 0℃; Stage #2: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone With sodium hydroxide In water at -5 - 10℃; pH=5.5 - 6; | 97.67% |
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
4-aminobenzene sulfonic acid
Conditions | Yield |
---|---|
Stage #1: 4-aminobenzene sulfonic acid With sodium hydroxide In water pH=7 - 8; Cooling with ice; Stage #2: With hydrogenchloride; sodium nitrite In water for 2.5h; Cooling with ice; Stage #3: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone In water for 2h; pH=8 - 9; Cooling with ice; | 92% |
Stage #1: 4-aminobenzene sulfonic acid With hydrogenchloride; sodium nitrite In water at 5 - 10℃; for 3h; Stage #2: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone With sodium hydroxide In water at 10℃; pH=5 - 8; | 78% |
Stage #1: 4-aminobenzene sulfonic acid With hydrogenchloride; sodium nitrite In water at 5 - 10℃; Stage #2: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone With sodium hydroxide In water at 10℃; pH=5 - 8; | 60.4 g |
2-Amino-4,5,6,7-tetrahydrobenzothiazole
3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone
Conditions | Yield |
---|---|
Stage #1: 2-Amino-4,5,6,7-tetrahydrobenzothiazole With hydrogenchloride; sodium nitrite In water at 0 - 5℃; for 2h; Stage #2: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone With acetic acid In water at 0 - 5℃; for 2h; | 88% |
Conditions | Yield |
---|---|
With sodium hydroxide; 2,4,7,9-tetramethyl-5-decyne-4,7-diol In water at 10 - 15℃; for 1.5h; pH=2 - 12; | 86% |
Conditions | Yield |
---|---|
Stage #1: anthranilic acid With sulfuric acid; acetic acid; sodium nitrite In water for 0.5h; Cooling with ice; Stage #2: 3-cyano-1-ethyl-6-hydroxy-4-methyl-2-pyridone In ethanol; water at 0 - 5℃; for 3h; | 86% |
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IUPAC Name: 1-ethyl-2-hydroxy-4-methyl-6-oxopyridine-3-carbonitrile
Empirical Formula: C9H10N2O2
Molecular Weight: 178.1879g/mol
EINECS: 248-865-5
Structure of 3-Pyridinecarbonitrile,1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo- (CAS NO.28141-13-1):
Index of Refraction: 1.574
Molar Refractivity: 46.28 cm3
Molar Volume: 140.1 cm3
Polarizability: 18.34×10-24cm3
Surface Tension: 55.6 dyne/cm
Density: 1.27 g/cm3
Flash Point: 138.2 °C
Enthalpy of Vaporization: 63.25 kJ/mol
Melting Point: 244-247 °C(lit.)
Boiling Point: 305 °C at 760 mmHg
Vapour Pressure: 7.99E-05 mmHg at 25°C
Product Categories: Intermediates of Dyes and Pigments;Pyridines;E-F;Stains and Dyes;Stains&Dyes, A to
Canonical SMILES: CCN1C(=O)C=C(C(=C1O)C#N)C
InChI: InChI=1S/C9H10N2O2/c1-3-11-8(12)4-6(2)7(5-10)9(11)13/h4,13H,3H2,1-2H3
InChIKey: YSNMMQRIPFUHAO-UHFFFAOYSA-N
Hazard Codes: Xn
Risk Statements: 20/21/22-36/37/38
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
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
3-Pyridinecarbonitrile,1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo- , its cas register number is 28141-13-1. It also can be called 1-Ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile . 3-Pyridinecarbonitrile,1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo- (CAS NO.28141-13-1) is harmful by inhalation, in contact with skin and if swallowed. It's also irritating to eyes, respiratory system and skin.