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Boronic acids and esters

4-Hexanoylphenylboronic acid

Also known as (4-hexanoylphenyl)boronic acid, 4-Hexanoylphenylboronicacid, Boronic acid, B-[4-(1-oxohexyl)phenyl]-

CAS 1106677-24-0Formula C12H17BO3Molar mass 220.08 g/mol
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4-Hexanoylphenylboronic acid chemical structure, C12H17BO3, CAS 1106677-24-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1106677-24-0
Formula
C12H17BO3
Molar mass
220.08 g/mol
HS code
293190
Category
Boronic acids and esters

What is 4-Hexanoylphenylboronic acid?

Plain description, key identifiers and synonyms

4-Hexanoylphenylboronic acid is a chemical substance with the molecular formula C12H17BO3 and a molar mass of 220.08 g/mol. Its CAS registry number is 1106677-24-0. The IUPAC name is (4-hexanoylphenyl)boronic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(4-hexanoylphenyl)boronic acid
CAS number
1106677-24-0 CAS number cross-checked
Molecular formula
C12H17BO3
MDL number
MFCD08701782
InChIKey
MDARDEFCXPDTJR-UHFFFAOYSA-N
InChI
InChI=1S/C12H17BO3/c1-2-3-4-5-12(14)10-6-8-11(9-7-10)13(15)16/h6-9,15-16H,2-5H2,1H3
SMILES (canonical and isomeric)
B(C1=CC=C(C=C1)C(=O)CCCCC)(O)O

Synonyms

  • (4-hexanoylphenyl)boronic acid
  • 4-Hexanoylphenylboronicacid
  • Boronic acid, B-[4-(1-oxohexyl)phenyl]-

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
220.08 g/molcalc.
Exact mass
220.1271 Dacalc.
LogP (octanol/water)
1.13calc.
Topological polar surface area
57.53 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
6calc.
Heavy atoms
16calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.42calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

4-Hexanoylphenylboronic acid suppliers

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4-Hexanoylphenylboronic acid price

Indicative price range per kg from live supplier offers

No published prices right now

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code 4-Hexanoylphenylboronic acid is traded under.

HS 2931.90Indicative HS code

Organo-inorganic compounds, other than tetramethyl lead, tetraethyl lead, tributyltin compounds…

World exports in 2024
$3.97B
+5.3% vs 2023, imports $3.93B
2019 to 2024
Top exporters
  1. China28.3%
  2. United States15.6%
  3. Germany15.1%
Top importers
  1. United States14.6%
  2. China13.0%
  3. South Korea8.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for 4-Hexanoylphenylboronic acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 4-Hexanoylphenylboronic acid, based on the data on this page

What is 4-Hexanoylphenylboronic acid?

4-Hexanoylphenylboronic acid is a chemical substance with the molecular formula C12H17BO3 and a molar mass of 220.08 g/mol. Its CAS registry number is 1106677-24-0. The IUPAC name is (4-hexanoylphenyl)boronic acid.

What is the CAS number of 4-Hexanoylphenylboronic acid?

The CAS registry number of 4-Hexanoylphenylboronic acid is 1106677-24-0.

What is the molecular formula and weight of 4-Hexanoylphenylboronic acid?

The molecular formula of 4-Hexanoylphenylboronic acid is C12H17BO3 and its molar mass is 220.08 g/mol.

What is 4-Hexanoylphenylboronic acid used for?

Known uses and roles of 4-Hexanoylphenylboronic acid include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 4-Hexanoylphenylboronic acid hazardous?

No GHS hazard classification for 4-Hexanoylphenylboronic acid is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of 4-Hexanoylphenylboronic acid?

4-Hexanoylphenylboronic acid is usually classified under HS code 293190 (X. ORGANO-INORGANIC COMPOUNDS, HETEROCYCLIC COMPOUNDS, NUCLEIC ACIDS AND THEIR SALTS…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy 4-Hexanoylphenylboronic acid?

Post a free request on CompoundList and suppliers of 4-Hexanoylphenylboronic acid will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 4-Hexanoylphenylboronic acid?

Suppliers quote 4-Hexanoylphenylboronic acid on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle 4-Hexanoylphenylboronic acid

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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