Allyl Methyl Carbonate

• CAS: 35466-83-2
• Catalog Number: ACM-MO-35466832
• Category: Polymer/Macromolecule; Allyl Monomers
• Molecular Weight: 116.12 g/mol
• Molecular Formula: C5H8O3
• Synonyms: Carbonic Acid Allyl Methyl Ester
• IUPAC Name: methyl prop-2-enyl carbonate
• Canonical SMILES: COC(=O)OCC=C
• InChI: 1S/C5H8O3/c1-3-4-8-5(6)7-2/h3H,1,4H2,2H3
• InChI Key: YHLVIDQQTOMBGN-UHFFFAOYSA-N
• Boiling Point: 131 °C
• Flash Point: 33 °C
• Density: 1.022 g/mL at 25 °C (lit.)
• Appearance: Colorless to Almost Colorless Clear Liquid
• Application: Employed in the Pd(0)-mediated synthesis of allyl aryl ethers and sulfides, and α,β-unsaturated carbonyls.
• Assay: 98%
• Complexity: 87.7
• Condition To Avoid: Moisture Sensitive
• Covalently-Bonded Unit Count: 1
• EC Number: 468-750-5
• Exact Mass: 116.047344g/mol
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• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 0
• Heavy Atom Count: 8
• MDL Number: MFCD00134545
• Monoisotopic Mass: 116.047344g/mol
• NACRES: NA.23
• Packaging: Packaging; 5, 25 mL in glass bottle
• Physical State: Liquid
• PubChem ID: 24863811
• Quality Level: 100
• Refractive Index: 1.41
• Rotatable Bond Count: 4
• Specific Gravity: 1.03
• XLogP3: 1.2

Custom Q&A

What is the PubChem CID of allyl methyl carbonate?

The PubChem CID of allyl methyl carbonate is 534788.

What is the molecular formula of allyl methyl carbonate?

The molecular formula of allyl methyl carbonate is C5H8O3.

What is the molecular weight of allyl methyl carbonate?

The molecular weight of allyl methyl carbonate is 116.11 g/mol.

What is the IUPAC name of allyl methyl carbonate?

The IUPAC name of allyl methyl carbonate is methyl prop-2-enyl carbonate.

What is the InChI of allyl methyl carbonate?

The InChI of allyl methyl carbonate is InChI=1S/C5H8O3/c1-3-4-8-5(6)7-2/h3H,1,4H2,2H3.

What is the InChIKey of allyl methyl carbonate?

The InChIKey of allyl methyl carbonate is YHLVIDQQTOMBGN-UHFFFAOYSA-N.

What is the canonical SMILES of allyl methyl carbonate?

The canonical SMILES of allyl methyl carbonate is COC(=O)OCC=C.

What is the CAS number of allyl methyl carbonate?

The CAS number of allyl methyl carbonate is 35466-83-2.

What is the European Community (EC) Number of allyl methyl carbonate?

The European Community (EC) Number of allyl methyl carbonate is 468-750-5 and 628-529-8.

Is allyl methyl carbonate a covalently-bonded unit?

Yes, allyl methyl carbonate is a covalently-bonded unit.