(4-Fluorophenyl)thiourea

• CAS: 459-05-2
• Catalog Number: ACM459052
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 170.21
• Molecular Formula: C₇H₇FN₂S
• Hazard Statements: H302 + H312 + H332-H315-H319-H335
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of (4-Fluorophenyl)thiourea?

The molecular formula of (4-Fluorophenyl)thiourea is C7H7FN2S.

What is the molecular weight of (4-Fluorophenyl)thiourea?

The molecular weight of (4-Fluorophenyl)thiourea is 170.21 g/mol.

What are some synonyms for (4-Fluorophenyl)thiourea?

Some synonyms for (4-Fluorophenyl)thiourea include 1-(4-fluorophenyl)thiourea, 1-(4-Fluorophenyl)-2-thiourea, and 4-fluorophenylthiourea.

When was (4-Fluorophenyl)thiourea first created?

(4-Fluorophenyl)thiourea was first created on March 27, 2005.

What is the InChIKey for (4-Fluorophenyl)thiourea?

The InChIKey for (4-Fluorophenyl)thiourea is BRWKXKNZRVALNZ-UHFFFAOYSA-N.

What is the XLogP3 value of (4-Fluorophenyl)thiourea?

The XLogP3 value of (4-Fluorophenyl)thiourea is 1.6.

How many hydrogen bond donor counts does (4-Fluorophenyl)thiourea have?

(4-Fluorophenyl)thiourea has 2 hydrogen bond donor counts.

What is the topological polar surface area of (4-Fluorophenyl)thiourea?

The topological polar surface area of (4-Fluorophenyl)thiourea is 70.1 Å2.

Is (4-Fluorophenyl)thiourea canonicalized as a compound?

Yes, (4-Fluorophenyl)thiourea is canonicalized as a compound.

How many covalently-bonded units are present in (4-Fluorophenyl)thiourea?

There is 1 covalently-bonded unit in (4-Fluorophenyl)thiourea.

Synthetic Use

Upstream Synthesis Route 1

• 399-07-5

• 459-05-2

Reference: [1]Verma, Anil Kumar; Bishnoi, Abha; Fatma, Shaheen; Parveen, Huda; Singh, Vineeta
[Drug Research, 2018, vol. 68, # 4, p. 222 - 231]

Upstream Synthesis Route 2

• 1544-68-9

• 459-05-2

Reference: [1]Prevost, Julien R.C.; Kozlova, Arina; Es Saadi, Bouazza; Yildiz, Esra; Modaffari, Sara; Lambert, Didier M.; Pochet, Lionel; Wouters, Johan; Dolušić, Eduard; Frédérick, Raphaël
[Tetrahedron Letters, 2018, vol. 59, # 49, p. 4315 - 4319]

Downstream Synthesis Route 1

• 459-05-2

• 348-40-3

Reference: [1] Biological and Pharmaceutical Bulletin, 2002, vol. 25, # 3, p. 335 - 341

Downstream Synthesis Route 2

• 459-05-2

• 78364-55-3

Reference: [1] Chemical Biology and Drug Design, 2016, p. 354 - 362

Downstream Synthesis Route 3

• 459-05-2

• 348-40-3

Reference: [1]Jacquot, Yves; Cleeren, Anny; Laios, Ioanna; Ma, Yan; Boulahdour, Athem; Bermont, Laurent; Refouvelet, Bernard; Adessi, Gerard; Leclercq, Guy; Xicluna, Alain
[Biological and Pharmaceutical Bulletin, 2002, vol. 25, # 3, p. 335 - 341]

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