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Screening compounds

Fourphit

Also known as 4-Isothiocyanato-1-(1-phenylcyclohexyl)piperidine, Piperidine, 4-isothiocyanato-1-(1-phenylcyclohexyl)-

CAS 104639-01-2Formula C18H24N2SMolar mass 300.47 g/mol
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Fourphit chemical structure, C18H24N2S, CAS 104639-01-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
104639-01-2
Formula
C18H24N2S
Molar mass
300.47 g/mol
HS code
293339
Category
Screening compounds

What is Fourphit?

Plain description, key identifiers and synonyms

Fourphit is a chemical substance with the molecular formula C18H24N2S and a molar mass of 300.47 g/mol. Its CAS registry number is 104639-01-2. The IUPAC name is 4-isothiocyanato-1-(1-phenylcyclohexyl)piperidine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4-isothiocyanato-1-(1-phenylcyclohexyl)piperidine
CAS number
104639-01-2 CAS number cross-checked
Molecular formula
C18H24N2S
UNII
EP455HL5XL
InChIKey
QAHYIAVTWZVTMY-UHFFFAOYSA-N
InChI
InChI=1S/C18H24N2S/c21-15-19-17-9-13-20(14-10-17)18(11-5-2-6-12-18)16-7-3-1-4-8-16/h1,3-4,7-8,17H,2,5-6,9-14H2
SMILES (canonical and isomeric)
C1CCC(CC1)(C2=CC=CC=C2)N3CCC(CC3)N=C=S

Synonyms

  • 4-Isothiocyanato-1-(1-phenylcyclohexyl)piperidine
  • Piperidine, 4-isothiocyanato-1-(1-phenylcyclohexyl)-

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
300.47 g/molcalc.
Exact mass
300.166 Dacalc.
LogP (octanol/water)
4.41calc.
Topological polar surface area
15.6 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
3calc.
Heavy atoms
21calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.61calc.
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, c1ccc(C2(N3CCCCC3)CCCCC2)cc1

c1ccc(C2(N3CCCCC3)CCCCC2)cc1

3 rings, 18 atoms, the Phencyclidine ring system.

74 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.

Fourphit suppliers

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Fourphit price

Indicative price range per kg from live supplier offers

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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

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 Fourphit is traded under.

HS 2933.39Indicative HS code

Heterocyclic compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure…

World exports in 2024
$9.16B
−17.9% vs 2023, imports $10.6B
2019 to 2024
Top exporters
  1. China21.5%
  2. India * partner reported12.3%
  3. Ireland11.6%
Top importers
  1. Germany14.2%
  2. United States12.8%
  3. Brazil10.1%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Fourphit?

Fourphit is a chemical substance with the molecular formula C18H24N2S and a molar mass of 300.47 g/mol. Its CAS registry number is 104639-01-2. The IUPAC name is 4-isothiocyanato-1-(1-phenylcyclohexyl)piperidine.

What is the CAS number of Fourphit?

The CAS registry number of Fourphit is 104639-01-2.

What is the molecular formula and weight of Fourphit?

The molecular formula of Fourphit is C18H24N2S and its molar mass is 300.47 g/mol.

What is Fourphit used for?

Known uses and roles of Fourphit include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Fourphit hazardous?

No GHS hazard classification for Fourphit 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 Fourphit?

Fourphit is usually classified under HS code 293339 (Compounds containing an unfused pyridine ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Fourphit?

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

What is the price of Fourphit?

Suppliers quote Fourphit 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 Fourphit

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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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