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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 |
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| 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% |
- 7647-01-0
hydrogenchloride
- 148-24-3
8-quinolinol
- 50-00-0
formaldehyd
- 7732-18-5
water
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 4053-44-5
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; |
- 67-56-1
methanol
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 7545-59-7
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% |
- 27757-85-3
2-Aminomethylthiophene
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 1215290-42-8
JLK 1535
| Conditions | Yield |
|---|---|
| With potassium carbonate In acetonitrile at 50℃; for 24h; | 95% |
- 1197-17-7, 1197-18-8, 701-54-2
4-aminomethyl-cyclohexanecarboxylic acid
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 1215290-47-3
4-((bis((8-hydroxyquinolin-5-yl)methyl)amino)methyl)-cyclohexanecarboxylic acid
| Conditions | Yield |
|---|---|
| With potassium carbonate In acetonitrile at 50℃; for 24h; | 95% |
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
| Conditions | Yield |
|---|---|
| With hydroxylamine; sodium hydrogencarbonate In tetrahydrofuran Reflux; | 94% |
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 142-84-7
di-n-propylamine
- 7545-63-3
5-dipropylaminomethyl-quinolin-8-ol
| Conditions | Yield |
|---|---|
| With triethylamine In dichloromethane at 20℃; for 0.416667h; | 93% |
- 4053-45-6
5-chloromethyl-8-hydroxyquinoline hydrochloride
- 122-39-4
diphenylamine
- 1065474-08-9
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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Chemistry
IUPAC Name: 5-(Chloromethyl)quinolin-8-ol
CAS NO: 4053-45-6
Molecular Formula: C10H8ClNO
Molecular Weight: 193.6296
Molecular Structure: .png)
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 Profile
Safety Information about 5-(Chloromethyl)-8-quinolinol (CAS NO.4053-45-6):
Hazard Codes: 
Xi