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CAS No.: | 4053-45-6 |
---|---|
Name: | 5-(CHLOROMETHYL)-8-QUINOLINOL HYDROCHLORIDE |
Article Data: | 42 |
Molecular Structure: | |
Formula: | C10H8ClNO |
Molecular Weight: | 230.094 |
Synonyms: | 5-(CHLOROMETHYL)QUINOLIN-8-OL HYDROCHLORIDE;5-(CHLOROMETHYL)-8-QUINOLINOL HYDROCHLORIDE;IFLAB-BB F2124-0006;TIMTEC-BB SBB000700;5-(Chloromethyl)-8-hydroxyquinoline hydrochloride;8-quinolinol, 5-(chloromethyl)-;5-(Chloromethyl)-8-quinolinol;8-Quinolinol, 5-(chloromethyl)-, hydrochloride |
Density: | 1.355g/cm3 |
Melting Point: | 280 °C (decomp) |
Boiling Point: | 388.1 °C at 760 mmHg |
Flash Point: | 188.5 °C |
Hazard Symbols: | |
Risk Codes: | 22 |
PSA: | 33.12000 |
LogP: | 3.48120 |
Conditions | Yield |
---|---|
With hydrogenchloride In water at 0 - 20℃; for 4h; | 99% |
With hydrogenchloride In water at 0 - 20℃; for 8h; | 98% |
With hydrogenchloride In water at 0 - 20℃; for 8h; Product distribution / selectivity; | 98% |
hydrogenchloride
8-quinolinol
formaldehyd
water
5-chloromethyl-8-hydroxyquinoline hydrochloride
5-chloromethyl-8-hydroxyquinoline hydrochloride
5-(hydroxymethyl)-8-hydroxyquinoline
Conditions | Yield |
---|---|
With ammonium hydroxide In diethyl ether | 99.99% |
With ammonium hydroxide In water at 20℃; for 0.25h; pH=9 - 10; | 99% |
With ammonia In water | 86% |
With ammonium hydroxide Substitution; |
methanol
5-chloromethyl-8-hydroxyquinoline hydrochloride
5-methoxymethyl-8-hydroxy-7-quinoline
Conditions | Yield |
---|---|
With sodium hydrogencarbonate Heating; | 99% |
Stage #1: methanol; 5-chloromethyl-8-hydroxyquinoline hydrochloride for 2h; Inert atmosphere; Reflux; Stage #2: With ammonium hydroxide In diethyl ether; water pH=8 - 10; | 88% |
Stage #1: methanol; 5-chloromethyl-8-hydroxyquinoline hydrochloride Reflux; Stage #2: With ammonium hydroxide In diethyl ether | 42% |
With sodium hydrogencarbonate for 2h; Reflux; |
Conditions | Yield |
---|---|
With N-ethyl-N,N-diisopropylamine In chloroform for 48h; | 95% |
2-Aminomethylthiophene
5-chloromethyl-8-hydroxyquinoline hydrochloride
JLK 1535
Conditions | Yield |
---|---|
With potassium carbonate In acetonitrile at 50℃; for 24h; | 95% |
4-aminomethyl-cyclohexanecarboxylic acid
5-chloromethyl-8-hydroxyquinoline hydrochloride
4-((bis((8-hydroxyquinolin-5-yl)methyl)amino)methyl)-cyclohexanecarboxylic acid
Conditions | Yield |
---|---|
With potassium carbonate In acetonitrile at 50℃; for 24h; | 95% |
5-chloromethyl-8-hydroxyquinoline hydrochloride
Conditions | Yield |
---|---|
With hydroxylamine; sodium hydrogencarbonate In tetrahydrofuran Reflux; | 94% |
5-chloromethyl-8-hydroxyquinoline hydrochloride
di-n-propylamine
5-dipropylaminomethyl-quinolin-8-ol
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 20℃; for 0.416667h; | 93% |
5-chloromethyl-8-hydroxyquinoline hydrochloride
diphenylamine
5-((diphenylamino)methyl)-quinolin-8-ol
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 20℃; for 0.416667h; | 91% |
With triethylamine In dichloromethane at 20℃; |
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IUPAC Name: 5-(Chloromethyl)quinolin-8-ol
CAS NO: 4053-45-6
Molecular Formula: C10H8ClNO
Molecular Weight: 193.6296
Molecular Structure:
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 22.12 Å2
Index of Refraction: 1.677
Molar Refractivity: 53.83 cm3
Molar Volume: 142.8 cm3
Surface Tension: 58.6 dyne/cm
Density: 1.355 g/cm3
Flash Point: 188.5 °C
Enthalpy of Vaporization: 66.22 kJ/mol
Boiling Point: 388.1 °C at 760 mmHg
Vapour Pressure: 1.41E-06 mmHg at 25°C
SMILES: ClCc1ccc(O)c2ncccc12
InChI: InChI=1/C10H8ClNO/c11-6-7-3-4-9(13)10-8(7)2-1-5-12-10/h1-5,13H,6H2
InChIKey: JGOBHUWKRDXZEY-UHFFFAOYAW
Std. InChI: InChI=1S/C10H8ClNO/c11-6-7-3-4-9(13)10-8(7)2-1-5-12-10/h1-5,13H,6H2
Std. InChIKey: JGOBHUWKRDXZEY-UHFFFAOYSA-N
Safety Information about 5-(Chloromethyl)-8-quinolinol (CAS NO.4053-45-6):
Hazard Codes: Xi