3-(Acetamido)benzeneboronic acid pinacol ester

• CAS: 480424-93-9
• Catalog Number: ACM480424939
• Category: Other
• Molecular Weight: 261.12
• Molecular Formula: C₁₄H₂₀BNO₃
• Synonyms: 578088_ALDRICH, BM078, 3-Acetamidophenylboronic acid pinacol ester, 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide, 480424-93-9
• IUPAC Name: N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
• Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NC(=O)C
• InChI Key: CZFSGYCLOCCASM-UHFFFAOYSA-N
• Boiling Point: 430.3ºC at 760mmHg
• Melting Point: 185-190ºC(lit.)
• Flash Point: 214ºC
• Density: 1.07g/cm³
• Exact Mass: 261.15400
• Hazard Statements: Xi
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Safety Description: S26-S36
• WGK Germany: 3

Custom Q&A

What is the PubChem CID of the compound?

PubChem CID: 2773989

What is the molecular formula of the compound?

Molecular Formula: C14H20BNO3

What are the synonyms of the compound?

Synonyms: 480424-93-9, N-(3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetamide, 3-Acetamidophenylboronic acid pinacol ester, N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide, 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide

What is the molecular weight of the compound?

Molecular Weight: 261.13 g/mol

What is the IUPAC name of the compound?

IUPAC Name: N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide

What is the InChI of the compound?

InChI: InChI=1S/C14H20BNO3/c1-10(17)16-12-8-6-7-11(9-12)15-18-13(2,3)14(4,5)19-15/h6-9H,1-5H3,(H,16,17)

What is the InChIKey of the compound?

InChIKey: CZFSGYCLOCCASM-UHFFFAOYSA-N

What is the canonical SMILES of the compound?

Canonical SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NC(=O)C

What is the CAS number of the compound?

CAS Number: 480424-93-9

What is the European Community (EC) number of the compound?

EC Number: 624-816-7