2-(tert-Butoxycarbonyl-phenyl-amino)-benzoic acid

• Catalog Number: ACMA00002580
• Category: Ethers
• Molecular Weight: 313.35
• Molecular Formula: C₁₈H₈O₄
• Hazard Statements: H302
• RIDADR: UN 3082 9 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound with PubChem CID 2757239?

The molecular formula is C18H19NO4.

What is the molecular weight of the compound?

The molecular weight is 313.3 g/mol.

What are some synonyms for the compound?

Some synonyms are n-boc-n-phenylanthranilic acid, 2-(tert-Butoxycarbonyl-phenyl-amino)-benzoic acid, and 2-((tert-Butoxycarbonyl)(phenyl)amino)benzoic acid.

When was the compound created in PubChem?

It was created on July 19, 2005.

What is the IUPAC name of the compound?

The IUPAC name is 2-[N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]benzoic acid.

What is the InChI of the compound?

The InChI is InChI=1S/C18H19NO4/c1-18(2,3)23-17(22)19(13-9-5-4-6-10-13)15-12-8-7-11-14(15)16(20)21/h4-12H,1-3H3,(H,20,21).

How many hydrogen bond donor counts does the compound have?

It has 1 hydrogen bond donor count.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 3.8.

What is the topological polar surface area of the compound?

The topological polar surface area is 66.8Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.