Ethyl acetoacetate(1,2,3,4-13c4)

• CAS: 84508-55-4
• Catalog Number: ACM84508554
• Category: Other Products
• Molecular Weight: 134.18
• Molecular Formula: C₆H₁₀O₃
• Synonyms: ETHYL ACETOACETATE (1,2,3,4-13C4);ETHYL ACETOACETATE-1,2,3,4-13C4, 99 ATOM% 13C;ETHYL 3-OXOBUTANATE(1,2,3,4-13C4);Ethyl Acetoacetate-13C4
• Boiling Point: 181°C(lit.)
• Melting Point: -43°C(lit.)
• Flash Point: 184°F
• Density: 1.052g/mL at 25°C
• Hazard Statements: Xi
• Safety Description: 26-36
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07

Custom Q&A

What is the molecular formula of Ethyl acetoacetate(1,2,3,4-13c4)?

The molecular formula is C6H10O3.

What is the molecular weight of Ethyl acetoacetate(1,2,3,4-13c4)?

The molecular weight is 134.11 g/mol.

What is the IUPAC name of Ethyl acetoacetate(1,2,3,4-13c4)?

The IUPAC name is ethyl 3-oxo(1,2,3,4-13C4)butanoate.

What is the InChI of Ethyl acetoacetate(1,2,3,4-13c4)?

The InChI is InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3/i2+1,4+1,5+1,6+1.

What is the InChIKey of Ethyl acetoacetate(1,2,3,4-13c4)?

The InChIKey is XYIBRDXRRQCHLP-XMUWKQMQSA-N.

What is the Canonical SMILES of Ethyl acetoacetate(1,2,3,4-13c4)?

The Canonical SMILES is CCOC(=O)CC(=O)C.

How many hydrogen bond acceptors does Ethyl acetoacetate(1,2,3,4-13c4) have?

It has 3 hydrogen bond acceptors.

What is the topological polar surface area of Ethyl acetoacetate(1,2,3,4-13c4)?

The topological polar surface area is 43.4 Å2.

Does Ethyl acetoacetate(1,2,3,4-13c4) have any defined atom stereocenter count?

No, it has 0 defined atom stereocenter count.

Is Ethyl acetoacetate(1,2,3,4-13c4) canonicalized as a compound?

Yes, it is canonicalized as a compound according to PubChem.