3-Fluoro-2-methylphenyl isocyanate

• CAS: 60221-81-0
• Catalog Number: ACM60221810
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 151.14
• Molecular Formula: C₈H₆ClFO₂
• Hazard Statements: H302
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 3-Fluoro-2-methylphenyl isocyanate?

The molecular formula is C8H6FNO.

What is the molecular weight of 3-Fluoro-2-methylphenyl isocyanate?

The molecular weight is 151.14 g/mol.

What are some synonyms of 3-Fluoro-2-methylphenyl isocyanate?

Some synonyms include 60221-81-0, 1-Fluoro-3-isocyanato-2-methylbenzene, and MFCD07779361.

When was 3-Fluoro-2-methylphenyl isocyanate created and last modified in PubChem?

It was created on 2007-02-08 and last modified on 2023-12-23.

What is the IUPAC name of 3-Fluoro-2-methylphenyl isocyanate?

The IUPAC name is 1-fluoro-3-isocyanato-2-methylbenzene.

What is the InChIKey of 3-Fluoro-2-methylphenyl isocyanate?

The InChIKey is OXJRWBPYWYAGNW-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 3-Fluoro-2-methylphenyl isocyanate have?

It has 3 hydrogen bond acceptors.

What is the topological polar surface area of 3-Fluoro-2-methylphenyl isocyanate?

The topological polar surface area is 29.4 Ų.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.

How many covalently-bonded units does 3-Fluoro-2-methylphenyl isocyanate have?

It has 1 covalently-bonded unit.

Synthetic Use

Upstream Synthesis Route 1

• 32315-10-9
• 443-86-7

• 60221-81-0

Reference: [1]Patent: US2007/249672,2007,A1 .Location in patent: Page/Page column 11

Downstream Synthesis Route 1

• 954127-42-5
• 60221-81-0

• 954127-43-6

Reference: [1]Patent: US2007/249672,2007,A1 .Location in patent: Page/Page column 11

Downstream Synthesis Route 2

• 622-33-3
• 60221-81-0

• 1400979-86-3

Reference: [1]ACS Medicinal Chemistry Letters,2012,vol. 3,p. 839 - 843,5

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