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Boronic acids and esters

Epetraborole

Also known as epetraborol, 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol, 1-Propanol, 3-(((3S)-3-(aminomethyl)-1,3-dihydro-1-hydroxy-2,1-benzoxaborol-7-yl)oxy)-

CAS 1093643-37-8Formula C11H16BNO4Molar mass 237.06 g/mol
1 supplier listed
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Epetraborole chemical structure, C11H16BNO4, CAS 1093643-37-8
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1093643-37-8
Formula
C11H16BNO4
Molar mass
237.06 g/mol
HS code
293190
Category
Boronic acids and esters

What is Epetraborole?

Plain description, key identifiers and synonyms

Epetraborole is a chemical substance with the molecular formula C11H16BNO4 and a molar mass of 237.06 g/mol. Its CAS registry number is 1093643-37-8. The IUPAC name is 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol
CAS number
1093643-37-8 CAS number cross-checked
Molecular formula
C11H16BNO4
UNII
6MC93Z2DF9
MDL number
MFCD28411360
InChIKey
FXQIIDINBDJDKL-SNVBAGLBSA-N
InChI
InChI=1S/C11H16BNO4/c13-7-10-8-3-1-4-9(16-6-2-5-14)11(8)12(15)17-10/h1,3-4,10,14-15H,2,5-7,13H2/t10-/m1/s1
Canonical SMILES
NCC1OB(O)c2c(OCCCO)cccc21
Isomeric SMILES
B1(C2=C(C=CC=C2OCCCO)[C@H](O1)CN)O

Synonyms

  • epetraborol
  • 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol
  • 1-Propanol, 3-(((3S)-3-(aminomethyl)-1,3-dihydro-1-hydroxy-2,1-benzoxaborol-7-yl)oxy)-
  • epetraborolum
  • 3-(((3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl)oxy)propan-1-ol
  • (3S)-3-(aminomethyl)-7-(3-hydroxypropoxy)-1,3-dihydro-2,1-benzoxaborol-1-ol
  • (S)-3-(aMinoMethyl)-7-(3-hydroxypropoxy)benzo[c][1,2]oxaborol-1(3H)-ol
  • GSK 2251052
  • (s)-3-aminomethyl-7-(3-hydroxy-propoxy)-3h-benzo[c][1,2]oxaborol-1-ol
  • AN3365, Epetraborole
  • BRII-658
  • (3S)-3-(Aminomethyl)-7-(3-hydroxypropoxy)-2,1-benzoxaborol-1(3H)-ol

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
237.06 g/molcalc.
Exact mass
237.1172 Dacalc.
LogP (octanol/water)
-0.83calc.
Topological polar surface area
84.94 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
5calc.
Heavy atoms
17calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.46calc.
Formal charge
0calc.
Stereocentres
1calc.
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, B1OCc2ccccc21

B1OCc2ccccc21

2 rings, 9 atoms.

533 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.

Epetraborole suppliers

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Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.

Where suppliers are based

1 supplier in 1 country

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Epetraborole price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Roles

  • antibacterial agent
  • antiinfective agent
  • antimicrobial agent
  • pharmaceutical

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 Epetraborole 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 Epetraborole is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Epetraborole, based on the data on this page

What is Epetraborole?

Epetraborole is a chemical substance with the molecular formula C11H16BNO4 and a molar mass of 237.06 g/mol. Its CAS registry number is 1093643-37-8. The IUPAC name is 3-[[(3S)-3-(aminomethyl)-1-hydroxy-3H-2,1-benzoxaborol-7-yl]oxy]propan-1-ol.

What is the CAS number of Epetraborole?

The CAS registry number of Epetraborole is 1093643-37-8.

What is the molecular formula and weight of Epetraborole?

The molecular formula of Epetraborole is C11H16BNO4 and its molar mass is 237.06 g/mol.

What is Epetraborole used for?

Known uses and roles of Epetraborole include building blocks in research and laboratory, screening compounds in research and laboratory, antibacterial agent, antiinfective agent, antimicrobial agent and 1 more.

Is Epetraborole hazardous?

No GHS hazard classification for Epetraborole 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 Epetraborole?

Epetraborole 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 Epetraborole?

CompoundList lists 1 supplier of Epetraborole in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Epetraborole?

Suppliers quote Epetraborole 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 Epetraborole

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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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