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Isotope-labelled compounds

Brombenperidol

Also known as 75Br-Brombenperidol, 77Br-Brombenperidol, 1-(77Br)bromanyl-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzimidazol-2-one

CAS 91433-73-7Formula C22H23BrFN3O2Molar mass 457.36 g/mol
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Brombenperidol chemical structure, C22H23BrFN3O2, CAS 91433-73-7
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
91433-73-7
Formula
C22H23BrFN3O2
Molar mass
457.36 g/mol
HS code
284443
Category
Isotope-labelled compounds

What is Brombenperidol?

Plain description, key identifiers and synonyms

Brombenperidol is a chemical substance with the molecular formula C22H23BrFN3O2 and a molar mass of 457.36 g/mol. Its CAS registry number is 91433-73-7. The IUPAC name is 1-(77Br)bromo-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzimidazol-2-one.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-(77Br)bromo-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzimidazol-2-one
CAS number
91433-73-7 CAS number cross-checked
Molecular formula
C22H23BrFN3O2
InChIKey
LLJNEZOZHARXFU-RQUWHVIDSA-N
InChI
InChI=1S/C22H23BrFN3O2/c23-27-20-5-2-1-4-19(20)26(22(27)29)18-11-14-25(15-12-18)13-3-6-21(28)16-7-9-17(24)10-8-16/h1-2,4-5,7-10,18H,3,6,11-15H2/i23-3
Canonical SMILES
O=C(CCCN1CCC(n2c(=O)n(Br)c3ccccc32)CC1)c1ccc(F)cc1
Isomeric SMILES
C1CN(CCC1N2C3=CC=CC=C3N(C2=O)[77Br])CCCC(=O)C4=CC=C(C=C4)F

Synonyms

  • 75Br-Brombenperidol
  • 77Br-Brombenperidol
  • 1-(77Br)bromanyl-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzimidazol-2-one
  • 1-(~77~Br)bromo-3-{1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl}-1,3-dihydro-2H-1,3-benzimidazol-2-one
  • 2H-Benzimidazol-2-one, ar-(bromo-77Br)-1-(1-(4-(4-fluorophenyl)-4-oxobutyl)-4-piperidinyl)-1,3-dihydro-

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
457.36 g/molcalc.
Exact mass
457.0988 Dacalc.
LogP (octanol/water)
4.4calc.
Topological polar surface area
47.24 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
6calc.
Heavy atoms
29calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.36calc.
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, O=C(CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccccc1

O=C(CCCN1CCC(n2c(=O)[nH]c3ccccc32)CC1)c1ccccc1

4 rings, 27 atoms, the 1-[1-(4-Oxo-4-phenylbutyl)-4-piperidinyl]-1,3-dihydro-2-benzimidazolone ring system.

18 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.

Brombenperidol suppliers

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Brombenperidol price

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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 Brombenperidol is traded under.

HS 2844.43Indicative HS code

Radioactive elements and isotopes and compounds other than those of subheading 284410…

World exports in 2024
$2.19B
+8.8% vs 2023, imports $2.53B
2022 to 2024
Top exporters
  1. Canada32.1%
  2. Netherlands17.0%
  3. Germany11.4%
Top importers
  1. United States37.8%
  2. Germany8.4%
  3. China5.8%
Reported customs values in USD, not prices.Full trade data

The HS code shown for Brombenperidol is indicative (it is known at chapter level only). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Brombenperidol?

Brombenperidol is a chemical substance with the molecular formula C22H23BrFN3O2 and a molar mass of 457.36 g/mol. Its CAS registry number is 91433-73-7. The IUPAC name is 1-(77Br)bromo-3-[1-[4-(4-fluorophenyl)-4-oxobutyl]piperidin-4-yl]benzimidazol-2-one.

What is the CAS number of Brombenperidol?

The CAS registry number of Brombenperidol is 91433-73-7.

What is the molecular formula and weight of Brombenperidol?

The molecular formula of Brombenperidol is C22H23BrFN3O2 and its molar mass is 457.36 g/mol.

What is Brombenperidol used for?

Known uses and roles of Brombenperidol include isotope-labelled compounds in research and laboratory.

Is Brombenperidol hazardous?

No GHS hazard classification for Brombenperidol 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 Brombenperidol?

Brombenperidol is usually classified under HS code 284443 (Radioactive elements and isotopes and compounds other than those of subheading 284410…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Brombenperidol?

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

What is the price of Brombenperidol?

Suppliers quote Brombenperidol 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 Brombenperidol

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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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