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| CAS No.: | 16473-35-1 |
|---|---|
| Name: | 4-(CHLOROMETHYL)BENZYL ALCOHOL 99 |
| Article Data: | 22 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H9ClO |
| Molecular Weight: | 156.612 |
| Synonyms: | 4-Chloromethylbenzyl alcohol;4-Hydroxymethylbenzyl chloride;[4-(Chloromethyl)phenyl]methanol;p-(Chloromethyl)benzyl alcohol;p-(Hydroxymethyl)benzyl chloride;1-(Chloromethyl)-4-(hydroxymethyl)benzene;Benzyl alcohol,p-(chloromethyl)- (6CI,8CI); |
| Density: | 1.195 g/cm3 |
| Melting Point: | 58-60 °C(lit.) |
| Boiling Point: | 275.9 °C at 760 mmHg |
| Flash Point: | 123.2 °C |
| Appearance: | white powder |
| Hazard Symbols: |
 C
|
| Risk Codes: | 34 |
| Safety: | 26-36/37/39-45 |
| Transport Information: | UN 1759 8/PG 2 |
| PSA: | 20.23000 |
| LogP: | 1.91770 |
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- 34040-64-7
p-methyloxycarbonylbenzyl chloride
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
| Conditions | Yield |
|---|---|
| With borane-THF In tetrahydrofuran at 20℃; for 2h; | 98% |
| With diisobutylaluminium hydride In hexane; dichloromethane at -78 - 0℃; Inert atmosphere; | 96% |
| With diisobutylaluminium hydride In dichloromethane at -78℃; | 91% |
- 1642-81-5
p-(chloromethyl)benzoic acid
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
| Conditions | Yield |
|---|---|
| With borane-THF In tetrahydrofuran at 20℃; | 96% |
| With diisobutylaluminum borohydride In tetrahydrofuran at 25℃; for 1h; Inert atmosphere; | 95% |
| In tetrahydrofuran; water | 78.3% |
- 589-29-7
p-xylylene glycol
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
| Conditions | Yield |
|---|---|
| With hydrogenchloride | 94% |
| With hydrogenchloride In toluene at 20℃; for 12h; | 80% |
| With thionyl chloride In chloroform at 0℃; for 1h; | 75% |
- 876-08-4
p-(chloromethyl)benzoyl chloride
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
| Conditions | Yield |
|---|---|
| With sodium tetrahydroborate In tetrahydrofuran; ethanol at 20℃; for 2h; Inert atmosphere; | 92% |
| With sodium tetrahydroborate In tetrahydrofuran; N,N-dimethyl-formamide at 20℃; for 1h; | 66.9% |
| With sodium tetrahydroborate; ethanol In tetrahydrofuran at 20℃; for 2h; Inert atmosphere; |
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 18162-48-6
tert-butyldimethylsilyl chloride
- 874883-18-8
tert-butyl-[[4-(chloromethyl)phenyl]methoxy]dimethylsilane
| Conditions | Yield |
|---|---|
| With 1H-imidazole In dichloromethane at 0℃; for 1h; | 100% |
| With 1H-imidazole; dmap In dichloromethane at 20℃; for 1h; Inert atmosphere; | 97% |
| With 1H-imidazole In dichloromethane at 0 - 20℃; for 1h; Inert atmosphere; |
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 439691-96-0
(4-(azidomethyl)phenyl)methanol
| Conditions | Yield |
|---|---|
| With sodium azide In N,N-dimethyl-formamide at 90℃; for 17h; | 100% |
| With sodium azide In N,N-dimethyl-formamide at 90℃; for 17h; | 100% |
| With sodium azide In N,N-dimethyl-formamide at 90℃; for 16h; |
- 5463-09-2
6-amino-2-butylamino-9H-purine
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 1421583-10-9
C17H22N6O
| Conditions | Yield |
|---|---|
| With potassium carbonate In N,N-dimethyl-formamide | 100% |
- 288-32-4
1H-imidazole
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 103573-92-8
4-((1H-imidazol-1-yl)methyl)phenylmethanol
| Conditions | Yield |
|---|---|
| Stage #1: 1H-imidazole With potassium hydroxide In acetonitrile at 20℃; for 1h; Stage #2: 4-(hydroxymethyl)benzyl chloride In acetonitrile at 90℃; for 16h; | 96% |
- 110-87-2
3,4-dihydro-2H-pyran
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 171358-70-6
4-<(tetrahydropyranyloxy)methyl>benzyl chloride
| Conditions | Yield |
|---|---|
| With pyridinium p-toluenesulfonate In dichloromethane for 24h; Ambient temperature; | 95% |
| With pyridinium p-toluenesulfonate; sodium hydrogencarbonate In dichloromethane | 95% |
| With hydrogenchloride In dichloromethane at 20℃; for 12h; | 86% |
- 865137-72-0
methyl 3-(4-{[(2-nitrophenyl)sulfonyl]amino}phenyl)propanoate
- 16473-35-1
4-(hydroxymethyl)benzyl chloride
- 865137-73-1
methyl 3-(4-{[4-(chloromethyl)benzyl][(2-nitrophenyl)sulfonyl]amino}phenyl)propanoate
| Conditions | Yield |
|---|---|
| Stage #1: methyl 3-(4-{[(2-nitrophenyl)sulfonyl]amino}phenyl)propanoate; 4-(hydroxymethyl)benzyl chloride With triphenylphosphine In toluene at 0℃; Stage #2: With diethylazodicarboxylate In toluene at 20℃; for 72h; | 95% |
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Specification
The Benzenemethanol,4-(chloromethyl)-, with the CAS registry number 16473-35-1, is also known as p-(Chloromethyl)benzyl alcohol. It belongs to the product categories of Alcohols; C7 to C8; Oxygen Compounds. This chemical's molecular formula is C8H9ClO and molecular weight is 156.61. What's more, its systematic name is [4-(chloromethyl)phenyl]methanol. It should be sealed and stored in a cool and dry place. Moreover, it should be protected from oxides.
Physical properties of Benzenemethanol,4-(chloromethyl)- are: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.3; (4)ACD/LogD (pH 7.4): 1.3; (5)ACD/BCF (pH 5.5): 5.76; (6)ACD/BCF (pH 7.4): 5.76; (7)ACD/KOC (pH 5.5): 121.88; (8)ACD/KOC (pH 7.4): 121.88; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 42.46 cm3; (15)Molar Volume: 130.9 cm3; (16)Polarizability: 16.83×10-24cm3; (17)Surface Tension: 43.3 dyne/cm; (18)Density: 1.195 g/cm3; (19)Flash Point: 123.2 °C; (20)Enthalpy of Vaporization: 54.33 kJ/mol; (21)Boiling Point: 275.9 °C at 760 mmHg; (22)Vapour Pressure: 0.0024 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, you must seek medical advice immediately (show the label where possible).
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1CO)CCl
(2)InChI: InChI=1S/C8H9ClO/c9-5-7-1-3-8(6-10)4-2-7/h1-4,10H,5-6H2
(3)InChIKey: OGALXJIOJZXBBP-UHFFFAOYSA-N