5-Fluoro-2-methylphenyl isocyanate

• CAS: 67191-93-9
• Catalog Number: ACM67191939
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 151.14
• Molecular Formula: C8H6NOF
• Hazard Statements: H315-H319-H335
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 5-Fluoro-2-methylphenyl isocyanate?

The molecular formula of 5-Fluoro-2-methylphenyl isocyanate is C8H6FNO.

What is the molecular weight of 5-Fluoro-2-methylphenyl isocyanate?

The molecular weight of 5-Fluoro-2-methylphenyl isocyanate is 151.14 g/mol.

What is the IUPAC name of 5-Fluoro-2-methylphenyl isocyanate?

The IUPAC name of 5-Fluoro-2-methylphenyl isocyanate is 4-fluoro-2-isocyanato-1-methylbenzene.

What are some synonyms for 5-Fluoro-2-methylphenyl isocyanate?

Some synonyms for 5-Fluoro-2-methylphenyl isocyanate include 67191-93-9 and 5-Fluoro-o-tolyl isocyanate.

What is the InChI key for 5-Fluoro-2-methylphenyl isocyanate?

The InChI key for 5-Fluoro-2-methylphenyl isocyanate is KRAMFLATTKXGOW-UHFFFAOYSA-N.

What is the XLogP3-AA value for 5-Fluoro-2-methylphenyl isocyanate?

The XLogP3-AA value for 5-Fluoro-2-methylphenyl isocyanate is 3.2.

How many hydrogen bond acceptor counts does 5-Fluoro-2-methylphenyl isocyanate have?

5-Fluoro-2-methylphenyl isocyanate has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of 5-Fluoro-2-methylphenyl isocyanate?

The topological polar surface area of 5-Fluoro-2-methylphenyl isocyanate is 29.4 Å2.

Does 5-Fluoro-2-methylphenyl isocyanate have any defined atom stereocenter counts?

No, 5-Fluoro-2-methylphenyl isocyanate does not have any defined atom stereocenter counts.

Is 5-Fluoro-2-methylphenyl isocyanate a canonicalized compound?

Yes, 5-Fluoro-2-methylphenyl isocyanate is a canonicalized compound according to PubChem.

Synthetic Use

Downstream Synthesis Route 1

• 67191-93-9
• 25814-07-7

• 1093222-15-1

Reference: [1]Location in patent: experimental part
Muro, Fumihito; Iimura, Shin; Yoneda, Yoshiyuki; Chiba, Jun; Watanabe, Toshiyuki; Setoguchi, Masaki; Iigou, Yutaka; Takayama, Gensuke; Yokoyama, Mika; Takashi, Tohru; Nakayama, Atsushi; Machinaga, Nobuo
[Bioorganic and Medicinal Chemistry, 2008, vol. 16, # 23, p. 9991 - 10000]

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