(4-Pentyloxyphenyl)boronic acid|

• Catalog Number: ACM146449903
• Product Name: (4-Pentyloxyphenyl)boronic acid|
• CAS: 146449-90-3
• Category: Boronic Acids
• IUPAC Name: (4-pentoxyphenyl)boronic acid
• Molecular Weight: 208.06g/mol
• Molecular Formula: C11H17BO3
• Canonical SMILES: B(C1=CC=C(C=C1)OCCCCC)(O)O
• InChI: InChI=1S/C11H17BO3/c1-2-3-4-9-15-11-7-5-10(6-8-11)12(13)14/h5-8,13-14H,2-4,9H2,1H3
• InChI Key: WHFKSJLAGACWMF-UHFFFAOYSA-N
• Complexity: 156
• Covalently-Bonded Unit Count: 1
• Exact Mass: 208.127075g/mol
• Formal Charge: 0
• H-Bond Acceptor: 3
• H-Bond Donor: 2
• Heavy Atom Count: 15
• Monoisotopic Mass: 208.127075g/mol
• Rotatable Bond Count: 6

Custom Q&A

What is the molecular formula of (4-Pentyloxyphenyl)boronic acid?

The molecular formula is C11H17BO3.

What is the molecular weight of (4-Pentyloxyphenyl)boronic acid?

The molecular weight is 208.06 g/mol.

What is the IUPAC name of (4-Pentyloxyphenyl)boronic acid?

The IUPAC name is (4-pentoxyphenyl)boronic acid.

What is the InChI of (4-Pentyloxyphenyl)boronic acid?

The InChI is InChI=1S/C11H17BO3/c1-2-3-4-9-15-11-7-5-10(6-8-11)12(13)14/h5-8,13-14H,2-4,9H2,1H3.

What is the InChIKey of (4-Pentyloxyphenyl)boronic acid?

The InChIKey is WHFKSJLAGACWMF-UHFFFAOYSA-N.

What is the canonical SMILES of (4-Pentyloxyphenyl)boronic acid?

The canonical SMILES is B(C1=CC=C(C=C1)OCCCCC)(O)O.

What is the CAS number of (4-Pentyloxyphenyl)boronic acid?

The CAS number is 146449-90-3.

What is the European Community (EC) number of (4-Pentyloxyphenyl)boronic acid?

The EC number is 834-832-8.

What is the monoisotopic mass of (4-Pentyloxyphenyl)boronic acid?

The monoisotopic mass is 208.1270746 g/mol.

Is (4-Pentyloxyphenyl)boronic acid a canonicalized compound?

Yes, (4-Pentyloxyphenyl)boronic acid is canonicalized.