3-(Butylaminocarbonyl)phenylboronic acid

CAS

397843-70-8

Catalog Number

ACM397843708

Category

Boronic Acids

Molecular Weight

221.06

Molecular Formula

C₁₁H₁₆BNO₃

MSDS COA Spec Sheet

If you have any other questions or need other size, please get a quote.

Specification

Synonyms

397843-70-8, 3-(Butylaminocarbonyl)phenylboronic acid, 3-(Butylaminocarbonyl)benzeneboronic acid, (3-(Butylcarbamoyl)phenyl)boronic acid, [3-(butylcarbamoyl)phenyl]boronic Acid, ACMC-209j7o, SureCN177577, AC1MW3I3, CTK4I1876, MolPort-001-767-588, 3-(butylcarbamoyl)phenylboronic acid, ANW-29170, OR3980, AKOS015839735, AB20408, AG-F-40586, 3-(Butylaminocarbonyl)phenylboronic acid,, AK-61801, KB-27463, X0776

IUPAC Name

[3-(butylcarbamoyl)phenyl]boronic acid

Canonical SMILES

B(C1=CC(=CC=C1)C(=O)NCCCC)(O)O

InChI Key

UMTGJEHDHSYNMS-UHFFFAOYSA-N

Melting Point

216-224ºC

Density

1.14g/cm³

Exact Mass

221.12200

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

H-Bond Donor

Safety Description

26-36/37/39

What is the molecular formula of 3-(Butylaminocarbonyl)phenylboronic acid?

The molecular formula of 3-(Butylaminocarbonyl)phenylboronic acid is C11H16BNO3.

What is the molecular weight of 3-(Butylaminocarbonyl)phenylboronic acid?

The molecular weight of 3-(Butylaminocarbonyl)phenylboronic acid is 221.06 g/mol.

What is the IUPAC name of 3-(Butylaminocarbonyl)phenylboronic acid?

The IUPAC name of 3-(Butylaminocarbonyl)phenylboronic acid is [3-(butylcarbamoyl)phenyl]boronic acid.

What is the InChI of 3-(Butylaminocarbonyl)phenylboronic acid?

The InChI of 3-(Butylaminocarbonyl)phenylboronic acid is InChI=1S/C11H16BNO3/c1-2-3-7-13-11(14)9-5-4-6-10(8-9)12(15)16/h4-6,8,15-16H,2-3,7H2,1H3,(H,13,14).

What is the InChIKey of 3-(Butylaminocarbonyl)phenylboronic acid?

The InChIKey of 3-(Butylaminocarbonyl)phenylboronic acid is UMTGJEHDHSYNMS-UHFFFAOYSA-N.

What is the canonical SMILES of 3-(Butylaminocarbonyl)phenylboronic acid?

The canonical SMILES of 3-(Butylaminocarbonyl)phenylboronic acid is B(C1=CC(=CC=C1)C(=O)NCCCC)(O)O.

What is the CAS number of 3-(Butylaminocarbonyl)phenylboronic acid?

The CAS number of 3-(Butylaminocarbonyl)phenylboronic acid is 397843-70-8.

What is the European Community (EC) number of 3-(Butylaminocarbonyl)phenylboronic acid?

The European Community (EC) number of 3-(Butylaminocarbonyl)phenylboronic acid is 813-451-0.

What is the DSSTox Substance ID of 3-(Butylaminocarbonyl)phenylboronic acid?

The DSSTox Substance ID of 3-(Butylaminocarbonyl)phenylboronic acid is DTXSID30395133.

Is 3-(Butylaminocarbonyl)phenylboronic acid a Canonicalized compound?

Yes, 3-(Butylaminocarbonyl)phenylboronic acid is a Canonicalized compound.