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Impurities and reference standards

Ipconazole impurity 4

Also known as (1S,2R,5S)-2-(4-Chlorobenzyl)-5-(propan-2-yl)-1-(1H-1,2,4-triazol-1-ylmethyl)-cyclopentanol, Cyclopentanol, 2-[(4-chlorophenyl)methyl]-5-(1-methylethyl)-1-(1H-1,2,4-triazol-1-ylmethyl)-, (1S,2R,5S)-

CAS 191166-39-9Formula C18H24ClN3OMolar mass 333.86 g/mol
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Ipconazole impurity 4 chemical structure, C18H24ClN3O, CAS 191166-39-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
191166-39-9
Formula
C18H24ClN3O
Molar mass
333.86 g/mol
HS code
293399
Category
Impurities and reference standards

What is Ipconazole impurity 4?

Plain description, key identifiers and synonyms

Ipconazole impurity 4 is a chemical substance with the molecular formula C18H24ClN3O and a molar mass of 333.86 g/mol. Its CAS registry number is 191166-39-9. The IUPAC name is (1S,2R,5S)-2-[(4-chlorophenyl)methyl]-5-propan-2-yl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(1S,2R,5S)-2-[(4-chlorophenyl)methyl]-5-propan-2-yl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol
CAS number
191166-39-9 CAS number cross-checked
Molecular formula
C18H24ClN3O
InChIKey
QTYCMDBMOLSEAM-NJAFHUGGSA-N
InChI
InChI=1S/C18H24ClN3O/c1-13(2)17-8-5-15(9-14-3-6-16(19)7-4-14)18(17,23)10-22-12-20-11-21-22/h3-4,6-7,11-13,15,17,23H,5,8-10H2,1-2H3/t15-,17+,18+/m1/s1
Canonical SMILES
CC(C)C1CCC(Cc2ccc(Cl)cc2)C1(O)Cn1cncn1
Isomeric SMILES
CC(C)[C@@H]1CC[C@@H]([C@]1(CN2C=NC=N2)O)CC3=CC=C(C=C3)Cl

Synonyms

  • (1S,2R,5S)-2-(4-Chlorobenzyl)-5-(propan-2-yl)-1-(1H-1,2,4-triazol-1-ylmethyl)-cyclopentanol
  • Cyclopentanol, 2-[(4-chlorophenyl)methyl]-5-(1-methylethyl)-1-(1H-1,2,4-triazol-1-ylmethyl)-, (1S,2R,5S)-

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
333.86 g/molcalc.
Exact mass
333.1608 Dacalc.
LogP (octanol/water)
3.59calc.
Topological polar surface area
50.94 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
5calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.56calc.
Formal charge
0calc.
Stereocentres
3calc.
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, c1ccc(CC2CCCC2Cn2cncn2)cc1

c1ccc(CC2CCCC2Cn2cncn2)cc1

3 rings, 18 atoms.

33 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.

Ipconazole impurity 4 suppliers

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Ipconazole impurity 4 price

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Ipconazole impurity 4 is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Ipconazole impurity 4, based on the data on this page

What is Ipconazole impurity 4?

Ipconazole impurity 4 is a chemical substance with the molecular formula C18H24ClN3O and a molar mass of 333.86 g/mol. Its CAS registry number is 191166-39-9. The IUPAC name is (1S,2R,5S)-2-[(4-chlorophenyl)methyl]-5-propan-2-yl-1-(1,2,4-triazol-1-ylmethyl)cyclopentan-1-ol.

What is the CAS number of Ipconazole impurity 4?

The CAS registry number of Ipconazole impurity 4 is 191166-39-9.

What is the molecular formula and weight of Ipconazole impurity 4?

The molecular formula of Ipconazole impurity 4 is C18H24ClN3O and its molar mass is 333.86 g/mol.

Is Ipconazole impurity 4 hazardous?

No GHS hazard classification for Ipconazole impurity 4 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 Ipconazole impurity 4?

Ipconazole impurity 4 is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Ipconazole impurity 4?

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What is the price of Ipconazole impurity 4?

Suppliers quote Ipconazole impurity 4 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 Ipconazole impurity 4

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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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