4-Hexen-3-one

• Catalog Number: ACM2497214
• Product Name: 4-Hexen-3-one
• CAS: 2497-21-4
• Category: Heterocyclic Organic Compound
• Synonyms: 2-Hexene-4-one
• IUPAC Name: (E)-Hex-4-en-3-one
• Molecular Weight: 98.14
• Molecular Formula: C₆H₁₀O
• Canonical SMILES: CCC(=O)C=CC
• InChI: InChI=1S/C6H10O/c1-3-5-6(7)4-2/h3,5H,4H2,1-2H3/b5-3+
• InChI Key: FEWIGMWODIRUJM-HWKANZROSA-N
• Boiling Point: 135-137 °C
• Melting Point: -71.05 °C
• Flash Point: 94 °F
• Density: 0.858 g/mL at 25 °C(lit.)
• Solubility: Slightly soluble in water; soluble in oil
• Exact Mass: 98.073164938
• Hazard Statements: Xn
• Isomeric SMILES: CCC(=O)/C=C/C
• Monoisotopic Mass: 98.073164938
• Physical State: Liquid
• Refractive Index: n20/D 1.44(lit.)
• Safety Description: 16-26-36/37/39
• Storage Conditions: Dry place,Room Temperature
• Supplemental Hazard Statements: H226-H302-H315-H319-H335
• Symbol: GHS02,GHS07
• Topological Polar Surface Area: 17.1 Ų

Custom Q&A

What is the molecular formula of 4-hexen-3-one?

The molecular formula is C6H10O.

What is the molecular weight of 4-hexen-3-one?

The molecular weight is 98.14 g/mol.

What is the IUPAC name of 4-hexen-3-one?

The IUPAC name is (E)-hex-4-en-3-one.

What are the synonyms for 4-hexen-3-one?

The synonyms for 4-hexen-3-one include 2497-21-4, (E)-hex-4-en-3-one, and 2-Hexen-4-one.

What is the CAS number of 4-hexen-3-one?

The CAS number is 50396-87-7.

What is the XLogP3-AA value of 4-hexen-3-one?

The XLogP3-AA value is 1.2.

How many hydrogen bond donor counts does 4-hexen-3-one have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-hexen-3-one have?

It has 1 hydrogen bond acceptor count.

How many rotatable bond counts does 4-hexen-3-one have?

It has 2 rotatable bond counts.

What is the exact mass of 4-hexen-3-one?

The exact mass is 98.073164938 g/mol.