4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester

• CAS: 480438-75-3
• Catalog Number: ACM480438753
• Category: Other
• Molecular Weight: 320.19
• Molecular Formula: C₁₇H₂₅BO₅
• Synonyms: 565946_ALDRICH, BM040, 4-Boc-oxyphenylboronic acid pinacol ester, 4-(tert-Butoxycarbonyloxy)phenylboronic acid pinacol ester, tert-Butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl Carbonate, 480438-75-3
• IUPAC Name: tert-butyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OC(=O)OC(C)(C)C
• InChI Key: JUKMJUAVZLWOOZ-UHFFFAOYSA-N
• Boiling Point: 414ºC at 760 mmHg
• Melting Point: 107-111ºC(lit.)
• Flash Point: 190.8ºC
• Density: 1.631g/cm³
• Exact Mass: 320.18000
• H-Bond Acceptor: 5
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The molecular formula is C17H25BO5.

When was 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester created in PubChem?

It was created on July 19, 2005.

What is the molecular weight of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The molecular weight is 320.2 g/mol.

What is the IUPAC name of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The IUPAC name is tert-butyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl] carbonate.

What is the InChIKey of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The InChIKey is JUKMJUAVZLWOOZ-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester have?

It has 5 hydrogen bond acceptor counts.

What is the exact mass of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The exact mass is 320.1795041 g/mol.

What is the topological polar surface area of 4-(Tert-butoxycarbonyloxy)phenylboronic acid pinacol ester?

The topological polar surface area is 54Ų.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.