CAS No.4415-82-1,Cyclobutanemethanol Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	4415-82-1
Name:	Cyclobutanemethanol
Article Data:	46

Formula:	C₅H₁₀O
Molecular Weight:	86.1338
Synonyms:	(Hydroxymethyl)cyclobutane;Cyclobutylcarbinol;Cyclobutylmethyl alcohol;
EINECS:	224-575-4
Density:	0.961 g/cm³
Melting Point:	68.5 °C
Boiling Point:	143.499 °C at 760 mmHg
Flash Point:	40 °C
Solubility:	Immiscible with water
Appearance:	Clear colourless liquid
Hazard Symbols:	R10:;
Risk Codes:	10
Safety:	16
Transport Information:	UN 1987 3/PG 3
PSA:	20.23000
LogP:	0.77880

Synthetic route

: C8H18OSi

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With methanol; 1,3-disulfonic acid imidazolium hydrogen sulfate at 20℃; for 0.0666667h; Green chemistry;	98%

: 3721-95-7
Cyclobutanecarboxylic acid

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In diethyl ether for 1.5h; Ambient temperature;	96%
With lithium aluminium tetrahydride In diethyl ether	72%
With lithium aluminium tetrahydride; diethyl ether

: 14924-53-9
ethyl cyclobutylcarboxylate

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In diethyl ether 1) rt, 24 h, 2) reflux, 1.5 h;	53%
With ethanol; sodium
Stage #1: ethyl cyclobutylcarboxylate With diethoxymethylane; zinc diacetate In toluene at 100℃; for 24h; Inert atmosphere; Stage #2: With methanol; potassium hydroxide chemoselective reaction;	65 %Chromat.

: 64-17-5
ethanol

: 3779-29-1
diethyl cyclobutane-1,1-dicarboxylate

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With sodium; toluene

: 3779-29-1
diethyl cyclobutane-1,1-dicarboxylate

A: 4415-73-0
[1-(hydroxymethyl)cyclobutyl]methanol

B: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With ethanol; sodium
With ethanol; sodium Erwaermen des Reaktionsgemisches auf 130-140grad;

: 89182-08-1
(1-cyclobutenyl)methyl alcohol

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With methanol; platinum Hydrogenation;

: 5006-22-4
Cyclobutanecarbonyl chloride

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With diethyl ether; sodium
With lithium aluminium tetrahydride In diethyl ether for 2h; Heating; Yield given;

: 1120-56-5
methylidenecyclobutane

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
(i) B2H6, THF, (ii) H2O2; Multistep reaction;

: 2987-17-9
cyclobutylaldehyde

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With sodium hydroxide at 80℃; for 42h;

: 15963-49-2
3-(hydroxymethyl)cyclobutene

: 4415-82-1
cyclobutanemethanol

Conditions

Conditions	Yield
With hydrogen; platinum(IV) oxide In methanol

Raw Materials

Downstream Products

137-43-9

110-15-6

Total:128 Page 1 of 4 1 2 3 4 Next>>

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Specification

The Cyclobutanemethanol, with the CAS registry number 4415-82-1, is also known as Hydroxymethylcyclobutane. It belongs to the product categories of API Intermediates; Cyclobutanes & Cyclobutenes; Simple 4-Membered Ring Compounds; Cycloalkanes; Alcohols; C2 to C6; Oxygen Compounds. Its EINECS registry number is 224-575-4. This chemical's molecular formula is C₅H₁₀O and molecular weight is 86.13. What's more, both its IUPAC name and systematic name are the same which is called Cyclobutylmethanol. When you are dealing with this chemical, you should be very careful. This chemical is flammable. Therefore, you should keep away from sources of ignition.

Physical properties about Cyclobutanemethanol are: (1)ACD/LogP: 0.737; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.74; (4)ACD/LogD (pH 7.4): 0.74; (5)ACD/BCF (pH 5.5): 2.14; (6)ACD/BCF (pH 7.4): 2.14; (7)ACD/KOC (pH 5.5): 60.00; (8)ACD/KOC (pH 7.4): 60.00; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.23 Å²; (13)Index of Refraction: 1.463; (14)Molar Refractivity: 24.676 cm³; (15)Molar Volume: 89.549 cm³; (16)Polarizability: 9.782×10^-24cm³; (17)Surface Tension: 37.253 dyne/cm; (18)Density: 0.962 g/cm³; (19)Flash Point: 40 °C; (20)Enthalpy of Vaporization: 44.341 kJ/mol; (21)Boiling Point: 143.499 °C at 760 mmHg; (22)Vapour Pressure: 2.137 mmHg at 25 °C.

Preparation of Cyclobutanemethanol: this chemical can be prepared by cyclobutanecarboxylic acid. This reaction needs reagent LiAlH₄ and solvent diethyl ether at ambient temperature. The reaction time is 1.5 hours. The yield is 96 %.

Cyclobutanemethanol can be prepared by cyclobutanecarboxylic acid.

Uses of Cyclobutanemethanol: (1) it is used as pharmaceutical intermediates; (2) it is used to produce other chemicals. For example, it can react with diketene to get cyclobutylmethyl acetoacetate. The reaction occurs with reagent NaH in oil at temperature of 70-80 °C. The reaction time is 2 hours. The yield is 88 %.

Cyclobutanemethano can react with diketene to get cyclobutylmethyl acetoacetate.

You can still convert the following datas into molecular structure:
(1) SMILES: OCC1CCC1
(2) InChI: InChI=1S/C5H10O/c6-4-5-2-1-3-5/h5-6H,1-4H2
(3) InChIKey: WPOPOPFNZYPKAV-UHFFFAOYSA-N