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Heterocyclic building blocks

Verofylline

Also known as Verofilina, Verofyllinum, CK 0383

CAS 66172-75-6Formula C12H18N4O2Molar mass 250.30 g/mol
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Verofylline chemical structure, C12H18N4O2, CAS 66172-75-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
66172-75-6
Formula
C12H18N4O2
Molar mass
250.30 g/mol
HS code
293359
Category
Heterocyclic building blocks

What is Verofylline?

Plain description, key identifiers and synonyms

Verofylline is a chemical substance with the molecular formula C12H18N4O2 and a molar mass of 250.30 g/mol. Its CAS registry number is 66172-75-6. The IUPAC name is 1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione
CAS number
66172-75-6 CAS number cross-checkedOther or deprecated CAS: 65029-11-0
Molecular formula
C12H18N4O2
UNII
1J8O1GT31U
InChIKey
MTBUJUHRXVGLEF-UHFFFAOYSA-N
InChI
InChI=1S/C12H18N4O2/c1-5-7(2)6-16-10-9(13-8(3)14-10)11(17)15(4)12(16)18/h7H,5-6H2,1-4H3,(H,13,14)
SMILES (canonical and isomeric)
CCC(C)CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C

Synonyms

  • Verofilina
  • Verofyllinum
  • CK 0383
  • 3,7-Dihydro-1,8-dimethyl-3-(2-methylbutyl)-1H-purine-2,6-dione
  • (+-)-1,8-Dimethyl-3-(2-methybutyl)xanthine
  • 1H-Purine-2,6-dione, 3,7-dihydro-1,8-dimethyl-3-(2-methylbutyl)-, (+-)-
  • 1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione
  • 1,8-dimethyl-3-(2-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
  • 1,8-Dimethyl-3-(2-methyl-1-butyl)xanthine
  • Verofylline (USAN/INN)
  • 1H-Purine-2,6-dione, 3,7-dihydro-1,8-dimethyl-3-(2-methylbutyl)-
  • (R,S)-1,2,3,6-Tetrahydro-1,8-dimethyl-3-(2-(methylbutyl)-2,6-purindion
  • (DL)-3,7-dihydro-1,8-dimethyl-3-(2-methylbutyl)-1H-purine-2,6-dione

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
250.30 g/molcalc.
Exact mass
250.143 Dacalc.
LogP (octanol/water)
0.78calc.
Topological polar surface area
72.68 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
3calc.
Heavy atoms
18calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.58calc.
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, O=c1[nH]c(=O)c2[nH]cnc2[nH]1

O=c1[nH]c(=O)c2[nH]cnc2[nH]1

2 rings, 11 atoms, the Xanthine ring system.

1,880 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.

Verofylline suppliers

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Where suppliers are based

1 supplier in 1 country

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Verofylline 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 Verofylline is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Verofylline?

Verofylline is a chemical substance with the molecular formula C12H18N4O2 and a molar mass of 250.30 g/mol. Its CAS registry number is 66172-75-6. The IUPAC name is 1,8-dimethyl-3-(2-methylbutyl)-7H-purine-2,6-dione.

What is the CAS number of Verofylline?

The CAS registry number of Verofylline is 66172-75-6. Other or deprecated CAS numbers: 65029-11-0.

What is the molecular formula and weight of Verofylline?

The molecular formula of Verofylline is C12H18N4O2 and its molar mass is 250.30 g/mol.

What is Verofylline used for?

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

Is Verofylline hazardous?

No GHS hazard classification for Verofylline 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 Verofylline?

Verofylline is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Verofylline?

CompoundList lists 1 supplier of Verofylline 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 Verofylline?

Suppliers quote Verofylline 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 Verofylline

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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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