3-Oxetanone
- Product Name
- 3-Oxetanone
- CAS No.
- 6704-31-0
- Chemical Name
- 3-Oxetanone
- Synonyms
- Oxetan-3-one;1,3-Epoxy-2-propanone;3-Oxooxetane, 1,3-Epoxypropan-2-one;EOS-60380;3-oxetanon;3-Oxetanone;oxentan-3-on;Oxetan-3-one 95%;3-Oxetanone, 98%+;3-Oxocyclobutanone
- CBNumber
- CB81235205
- Molecular Formula
- C3H4O2
- Formula Weight
- 72.06
- MOL File
- 6704-31-0.mol
3-Oxetanone Property
- Boiling point:
- 140 °C
- Density
- 1.231
- Flash point:
- 53 °C
- refractive index
- 1.426
- storage temp.
- -20°C
- solubility
- Miscible with tetrahydrofuran.
- form
- clear liquid
- color
- Colorless to Red to Green
- InChI
- InChI=1S/C3H4O2/c4-3-1-5-2-3/h1-2H2
- InChIKey
- ROADCYAOHVSOLQ-UHFFFAOYSA-N
- SMILES
- O1CC(=O)C1
Safety
- Hazard Codes
- Xn
- Risk Statements
- 10-22-37/38-41-43
- Safety Statements
- 16-26-36/37/39
- RIDADR
- 1993
- WGK Germany
- 3
- HazardClass
- 3
- HazardClass
- IRRITANT
- PackingGroup
- Ⅲ
- HS Code
- 29329990
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Danger
- Hazard statements
-
H226Flammable liquid and vapour
H302Harmful if swallowed
H315Causes skin irritation
H317May cause an allergic skin reaction
H318Causes serious eye damage
H335May cause respiratory irritation
- Precautionary statements
-
P210Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233Keep container tightly closed.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- 731536
- Product name
- 3-Oxetanone
- Packaging
- 2g
- Price
- $176
- Updated
- 2024/03/01
- Product number
- 731536
- Product name
- 3-Oxetanone
- Packaging
- 10g
- Price
- $254.4
- Updated
- 2024/03/01
- Product number
- O0467
- Product name
- 3-Oxetanone
- Purity
- >97.0%(GC)
- Packaging
- 1g
- Price
- $99
- Updated
- 2024/03/01
- Product number
- O0467
- Product name
- 3-Oxetanone
- Purity
- >97.0%(GC)
- Packaging
- 5g
- Price
- $295
- Updated
- 2024/03/01
- Product number
- H57870
- Product name
- 3-Oxetanone, 95%
- Packaging
- 1g
- Price
- $130.65
- Updated
- 2024/03/01
3-Oxetanone Chemical Properties,Usage,Production
Chemical Properties
Colorless liquid
Uses
3-Oxetanone is used as a starting material for the preparation of other oxetanes compounds, which are of pharmacological interest. It is also considered as an object for theoretical studies.
Uses
3-Oxetanone can be used to synthesize:
- Various oxetane-containing lead compounds with improved solubility, reduced lipophilicity and amphiphilicity.
- (Hydroxymethyl)oxazoles and (hydroxymethyl)thiazoles via single-step microwave mediated reaction with primary amides and thioamides, respectively.
- Oxetane containing spirocycles through thermal 1,3-dipolar cycloaddition reaction with α-amino acids or secondary α-amino acid esters.
Definition
3-oxetanone (1,3-epoxy2-propanone, c?C3H4O2) is a highly strained molecule functional in ring expansion and addition reactions. This molecule has also been proposed as a decomposition product of acetonylperoxy radical in the atmosphere. 3-oxetanone is suspected in the decomposition of the acetonylperoxy radical, an intermediate formed during the atmospheric processing of acetone. Atmospheric acetone degradation produces the acetonyl radical, CH3C(O)CH2, which reacts with O2 to form the acetonylperoxy radical. Rate constants predicted by a canonical variational theory/small-curvature tunneling method show that the radical isomerising produces 3-oxetanone and hydroxyl radical. These are the dominant products in the 250?2000 K range. There is no significant branching to other products below 1200 K. The only published study of the dissociation of 3-oxetanone is a Rice-Ramsperger-KasselMarcus (RRKM) analysis of the unimolecular rate constant for the photolysis of 3-oxetanone, producing ketene and formaldehyde[1-2].
General Description
Product may polymerize over time during storage.
References
[1] Sumitra Godara, Manikandan Paranjothy, Pooja Verma. “Dissociation Chemistry of 3-Oxetanone in the Gas Phase.” The Journal of Physical Chemistry A 121 36 (2017): 6679–6686.
[2] Emily M. Wright. “Pyrolysis Reactions of 3-Oxetanone.” The Journal of Physical Chemistry A 119 29 (2015): 7966–7972.
3-Oxetanone Preparation Products And Raw materials
Raw materials
Preparation Products
3-Oxetanone Suppliers
- Tel
- --
- Fax
- --
- nfo@matrix-fine-chemicals.com
- Country
- Switzerland
- ProdList
- 6968
- Advantage
- 58
- Tel
- --
- Fax
- --
- contact@spirochem.com
- Country
- Switzerland
- ProdList
- 1
- Advantage
- 0
View Lastest Price from 3-Oxetanone manufacturers
- Product
- 3-Oxetanone 6704-31-0
- Price
- US $998.00/ASSAYS
- Min. Order
- 1ASSAYS
- Purity
- 98%
- Supply Ability
- 1T
- Release date
- 2020-06-28
- Product
- 3-Oxetanone 6704-31-0
- Price
- US $998.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 1T
- Release date
- 2020-06-28
- Product
- 3-Oxetanone 6704-31-0
- Price
- US $10.00/KG
- Min. Order
- 1KG
- Purity
- 99%
- Supply Ability
- 10 mt
- Release date
- 2023-02-20