4-Amino-3-penten-2-one

• CAS: 1118-66-7
• Catalog Number: ACM1118667
• Category: Amines
• Molecular Weight: 99.13
• Molecular Formula: C₅H₉NO₂
• Hazard Statements: H319
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 4-Amino-3-penten-2-one?

The molecular formula is C5H9NO.

What is the molecular weight of 4-Amino-3-penten-2-one?

The molecular weight is 99.13 g/mol.

What is the IUPAC name of 4-Amino-3-penten-2-one?

The IUPAC name is (Z)-4-aminopent-3-en-2-one.

What is the InChIKey of 4-Amino-3-penten-2-one?

The InChIKey is OSLAYKKXCYSJSF-ARJAWSKDSA-N.

What is the canonical SMILES of 4-Amino-3-penten-2-one?

The canonical SMILES is CC(=CC(=O)C)N.

What is the CAS number of 4-Amino-3-penten-2-one?

The CAS number is 23652-84-8.

How many hydrogen bond donor count does 4-Amino-3-penten-2-one have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor count does 4-Amino-3-penten-2-one have?

It has 2 hydrogen bond acceptor count.

What is the topological polar surface area of 4-Amino-3-penten-2-one?

The topological polar surface area is 43.1Ų.

How many rotatable bond count does 4-Amino-3-penten-2-one have?

It has 1 rotatable bond count.

Synthetic Use

Upstream Synthesis Route 1

• 300-87-8
• 4294-57-9

• 1118-66-7
• 613-33-2
• 56570-34-4

Reference: [1]Patent: KR2019/14218,2019,A .Location in patent: Paragraph 0460; 0464-0466

Downstream Synthesis Route 1

• 5444-80-4
• 1118-66-7

• 1721-12-6

Reference: [1] Chemische Berichte, 1939, vol. 72, p. 563,566
[2] Chemische Berichte, 1949, vol. 82, p. 117,119
[3] Chemische Berichte, 1939, vol. 72, p. 563,566
[4] Chemische Berichte, 1949, vol. 82, p. 117,119
[5] Chemische Berichte, vol. 72, p. 1550

Downstream Synthesis Route 2

• 1118-66-7

• 300-87-8

Reference: [1] Bulletin de la Societe Chimique de France, 1892, vol. <3> 7, p. 791

Downstream Synthesis Route 3

• 1118-66-7

• 1721-12-6

Reference: [1] Chemische Berichte, 1957, vol. 90, p. 2265,2270

Downstream Synthesis Route 4

• 5444-80-4
• 1118-66-7

• 1721-12-6

Reference: [1]Chemische Berichte,1939,vol. 72,p. 563,566
[2]Chemische Berichte,1939,vol. 72,p. 563,566

Downstream Synthesis Route 5

• 1118-66-7
• 123-29-5

• 101961-21-1

Reference: [1]Tetrahedron,1973,vol. 29,p. 3185 - 3187

* For details of the synthesis route, please refer to the original source to ensure accuracy.