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2453-03-4

2453-03-4 Structure

2453-03-4 Structure
IdentificationBack Directory
[Name]

1,3-Dioxan-2-one
[CAS]

2453-03-4
[Synonyms]

1,3-Dioxan-2-one
1,3-Dioxan-2-one>
1,3-Propylene carbonate
1,3-Propanediol cyclic carbonate
Trimethylene carbonate (TMC) ,99%
Carbonic acid 1,3-propanediyl ester
trimethylene carbonate1,3-Dioxan-2-one
TIANFU-CHEM CAS NO.2453-03-4 1,3-Dioxan-2-one
[EINECS(EC#)]

607-395-4
[Molecular Formula]

C4H6O3
[MDL Number]

MFCD00010440
[MOL File]

2453-03-4.mol
[Molecular Weight]

102.09
Chemical PropertiesBack Directory
[Melting point ]

45.0 to 49.0 °C
[Boiling point ]

135°C/4mmHg(lit.)
[density ]

1.200±0.06 g/cm3(Predicted)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[color ]

White to Almost white
[InChI]

InChI=1S/C4H6O3/c5-4-6-2-1-3-7-4/h1-3H2
[InChIKey]

YFHICDDUDORKJB-UHFFFAOYSA-N
[SMILES]

O1CCCOC1=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H319
[Precautionary statements ]

P264-P280-P305+P351+P338+P337+P313
[Risk Statements ]

22-36
[Safety Statements ]

24/25
[HS Code ]

29147000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Cyclohexyl ether
[Preparation Products]

3-Phenoxy-1-propanol-->1-(3-Hydroxypropyl)-1H-imidazole-->3-(2-methyl-1H-imidazol-1-yl)propan-1-ol(SALTDATA: HCl)
Hazard InformationBack Directory
[Description]

1,3-Dioxan-2-one is a cyclic carbonate ester with the chemical formula C4H6O3. 1,3-Dioxan-2-one, also known as Trimethylene Carbonate, is a colorless solid and 6-membered cyclic carbonate ester used to manufacture medical device biodegradable polymers. This potential monomer continues to play an overwhelming role in synthesizing aliphatic polycarbonates and polyurethanes, which are of interest for biomedical applications because of their low toxicity and biodegradability. The most common preparation of 1,3-dioxan-2-one (six-membered cyclic carbonate) monomers involves the reaction of 1,3-diols with phosgene derivatives or carbon monoxide[1].
[Uses]

1,3-Dioxan-2-one is used to synthesize polytrimethylene carbonate (PTMC).
[References]

[1] Hosseinian, Akram et al. “Advancements in six-membered cyclic carbonate (1,3-dioxan-2-one) synthesis utilizing carbon dioxide as a C1 source.” RSC Advances 32 (2018): 17976–17988.
Spectrum DetailBack Directory
[Spectrum Detail]

1,3-Dioxan-2-one(2453-03-4)1HNMR
1,3-Dioxan-2-one(2453-03-4)IR1
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