4-Penten-1-ol

• CAS: 821-09-0
• Catalog Number: ACM821090
• Category: Alkenes
• Molecular Weight: 86.134g/mol
• Molecular Formula: C5H10O
• Synonyms: S14-0957; UNII-W0558TQC6F; ACN-S003547; 4-Pentenol; TC-060303; InChI=1/C5H10O/c1-2-3-4-5-6/h2,6H,1,3-5H2; ZINC1632700; A840248; 821-09-0; CH2=CHCH2CH2CH₂OH
• IUPAC Name: pent-4-en-1-ol
• SMILES: C=CCCCO
• InChI: InChI=1S/C5H10O/c1-2-3-4-5-6/h2,6H,1,3-5H2
• InChI Key: LQAVWYMTUMSFBE-UHFFFAOYSA-N
• Solubility: 0.66 M
• Application: 4-Penten-1-ol is a reagent used in carbohydrate chemistry for n-Pentenyl Glycoside methodology for the rapid assembly of homoglycans exemplified with the nonasaccharide component of a high-mannose glycoprotein.
• Storage: 2-8°C
• Complexity: 32.9
• Covalently-Bonded Unit Count: 1
• EC Number: 212-473-2
• Exact Mass: 86.073g/mol
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• Heavy Atom Count: 6
• Monoisotopic Mass: 86.073g/mol
• NSC Number: 97503
• Rotatable Bond Count: 3
• Topological Polar Surface Area: 20.2A^2
• UNII: W0558TQC6F

Custom Q&A

What is the molecular formula of 4-Penten-1-ol?

The molecular formula of 4-Penten-1-ol is C5H10O.

What is the molecular weight of 4-Penten-1-ol?

The molecular weight of 4-Penten-1-ol is 86.13 g/mol.

What are some synonyms of 4-Penten-1-ol?

Synonyms of 4-Penten-1-ol include Pent-4-en-1-ol, 4-Pentenol, and 4-Pentenyl alcohol.

When was 4-Penten-1-ol first created?

4-Penten-1-ol was first created on March 26, 2005.

What is the InChIKey of 4-Penten-1-ol?

The InChIKey of 4-Penten-1-ol is LQAVWYMTUMSFBE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-Penten-1-ol have?

4-Penten-1-ol has 1 hydrogen bond donor count.

What is the topological polar surface area of 4-Penten-1-ol?

The topological polar surface area of 4-Penten-1-ol is 20.2Ų.

How many rotatable bond counts does 4-Penten-1-ol have?

4-Penten-1-ol has 3 rotatable bond counts.

Is 4-Penten-1-ol a canonicalized compound?

Yes, 4-Penten-1-ol is a canonicalized compound.

What is the complexity value of 4-Penten-1-ol?

The complexity value of 4-Penten-1-ol is 32.9.

Synthetic Use

Upstream Synthesis Route 1

• 110-87-2

• 19752-84-2
• 626-95-9
• 111-29-5
• 821-09-0

Reference: [1] Journal of Organic Chemistry, 1985, vol. 50, # 10, p. 1582 - 1589

Upstream Synthesis Route 2

• 95650-50-3

• 4801-58-5
• 2937-83-9
• 821-09-0

Reference: [1] Collection of Czechoslovak Chemical Communications, 1984, vol. 49, # 10, p. 2410 - 2414

Downstream Synthesis Route 1

• 821-09-0

• 1119-51-3

Reference: [1] Tetrahedron, 2004, vol. 60, # 48, p. 10943 - 10948

Downstream Synthesis Route 2

• 821-09-0

• 928-50-7

Reference: [1]Patent: CN105837396,2016,A .Location in patent: Paragraph 0038; 0039

Downstream Synthesis Route 3

• 821-09-0
• 98-59-9

• 19300-54-0

Reference: [1]Journal of the American Chemical Society,2018,vol. 140,p. 13976 - 13984

Downstream Synthesis Route 4

• 821-09-0
• 98-88-4

• 29264-40-2

Reference: [1]Synthesis,2018,vol. 50,p. 4683 - 4689

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