4-(2-tert-Butoxycarbonylamino-ethoxy)-benzoic acid

• Catalog Number: ACMA00002402
• Category: Ethers
• Molecular Weight: 281.30
• Molecular Formula: C₁₄H₁₉NO₄
• Hazard Statements: H302-H319
• RIDADR: NONH for all modes of transport
• Symbol: GHS07

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C14H19NO5.

What are the synonyms for the compound?

The synonyms for the compound are 168892-66-8, 4-(2-((tert-Butoxycarbonyl)amino)ethoxy)benzoic acid, 4-[2-(Boc-amino)ethyloxy]benzoic acid, 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]benzoic Acid.

What is the molecular weight of the compound?

The molecular weight is 281.30 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]benzoic acid.

What is the InChI of the compound?

The InChI is InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15-8-9-19-11-6-4-10(5-7-11)12(16)17/h4-7H,8-9H2,1-3H3,(H,15,18)(H,16,17).

What is the InChIKey of the compound?

The InChIKey is COIQSXDNBXSYMY-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CC(C)(C)OC(=O)NCCOC1=CC=C(C=C1)C(=O)O.

What is the CAS number of the compound?

The CAS number is 168892-66-8.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 2.1.

Is the compound canonicalized?

Yes, the compound is canonicalized.