3-Hydroxytetrahydrofuran

• CAS: 453-20-3
• Catalog Number: ACM453203
• Category: Furans
• Molecular Weight: 88.11
• Molecular Formula: C4H8O2
• Boiling Point: 181 °C at 760 mmHg
• Flash Point: 81°C(lit.)
• Density: 1.09 g/mL at 25 °C(lit.)

Custom Q&A

What is the PubChem CID of 3-Hydroxytetrahydrofuran?

The PubChem CID of 3-Hydroxytetrahydrofuran is 9960.

What is the molecular formula of 3-Hydroxytetrahydrofuran?

The molecular formula of 3-Hydroxytetrahydrofuran is C4H8O2.

What is the molecular weight of 3-Hydroxytetrahydrofuran?

The molecular weight of 3-Hydroxytetrahydrofuran is 88.11 g/mol.

What is the IUPAC name of 3-Hydroxytetrahydrofuran?

The IUPAC name of 3-Hydroxytetrahydrofuran is oxolan-3-ol.

What is the InChI of 3-Hydroxytetrahydrofuran?

The InChI of 3-Hydroxytetrahydrofuran is InChI=1S/C4H8O2/c5-4-1-2-6-3-4/h4-5H,1-3H2.

What is the InChIKey of 3-Hydroxytetrahydrofuran?

The InChIKey of 3-Hydroxytetrahydrofuran is XDPCNPCKDGQBAN-UHFFFAOYSA-N.

What is the canonical SMILES of 3-Hydroxytetrahydrofuran?

The canonical SMILES of 3-Hydroxytetrahydrofuran is C1COCC1O.

What is the CAS number of 3-Hydroxytetrahydrofuran?

The CAS number of 3-Hydroxytetrahydrofuran is 453-20-3.

What is the XLogP3-AA value of 3-Hydroxytetrahydrofuran?

The XLogP3-AA value of 3-Hydroxytetrahydrofuran is -0.4.

How many defined bond stereocenters are there in 3-Hydroxytetrahydrofuran?

There are 0 defined bond stereocenters in 3-Hydroxytetrahydrofuran.

Synthetic Use

Upstream Synthesis Route 1

• 3068-00-6

• 453-20-3

Reference: [1] Patent: WO2005/121111, 2005, A1, . Location in patent: Page/Page column 33

Upstream Synthesis Route 2

• 627-27-0

• 453-20-3

Reference: [1] Chemical Communications, 1998, # 4, p. 463 - 464
[2] Annales de Chimie (Cachan, France), 1911, vol. <8>24, p. 330[3] Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1910, vol. 150, p. 1056
[4] Journal of Catalysis, 1999, vol. 182, # 2, p. 349 - 356

Upstream Synthesis Route 3

• 285-69-8

• 453-20-3

Reference: [1]Journal of the Chemical Society,1959,p. 248,254

Upstream Synthesis Route 4

• 22929-52-8

• 453-20-3

Reference: [1]Journal of the Chemical Society,1959,p. 248,254
[2]Proceedings of the National Academy of Sciences of the United States of America,2015,vol. 112,p. E7065 - E7072

Upstream Synthesis Route 5

• 627-27-0

• 453-20-3

Reference: [1]Current Patent Assignee: QINGDAO HUAHE PHARMACEUTICAL TECH - CN113248461, 2021, A
Location in patent: Paragraph 0049-0070
[2]Bhaumik, Asim; Tatsumi, Takashi
[Chemical Communications, 1998, # 4, p. 463 - 464]
[3]Pariselle
[Annales de Chimie (Cachan, France), 1911, vol. <8>24, p. 330][Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, 1910, vol. 150, p. 1056]
[4]Bhaumik, Asim; Tatsumi, Takashi
[Journal of Catalysis, 1999, vol. 182, # 2, p. 349 - 356]

Downstream Synthesis Route 1

• 453-20-3

• 19311-37-6

Reference: [1] Chemical Communications, 1997, # 11, p. 1067 - 1068
[2] Tetrahedron, 1981, vol. 37, p. 781 - 787

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