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Screening compounds

Hydroxymethylflavin

Also known as Benzo(g)pteridine-2,4(3H,10H)-dione, 10-((acetyloxy)methyl)-7,8-dimethyl-, (7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)methyl acetate, (7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2h)-yl)methyl acetate

CAS 35847-78-0Formula C15H14N4O4Molar mass 314.30 g/mol
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Hydroxymethylflavin chemical structure, C15H14N4O4, CAS 35847-78-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
35847-78-0
Formula
C15H14N4O4
Molar mass
314.30 g/mol
HS code
293359
Category
Screening compounds

What is Hydroxymethylflavin?

Plain description, key identifiers and synonyms

Hydroxymethylflavin is a chemical substance with the molecular formula C15H14N4O4 and a molar mass of 314.30 g/mol. Its CAS registry number is 35847-78-0. The IUPAC name is (7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)methyl acetate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)methyl acetate
CAS number
35847-78-0 CAS number cross-checked
Molecular formula
C15H14N4O4
InChIKey
KEDBIZKNSLJORX-UHFFFAOYSA-N
InChI
InChI=1S/C15H14N4O4/c1-7-4-10-11(5-8(7)2)19(6-23-9(3)20)13-12(16-10)14(21)18-15(22)17-13/h4-5H,6H2,1-3H3,(H,18,21,22)
SMILES (canonical and isomeric)
CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)COC(=O)C

Synonyms

  • Benzo(g)pteridine-2,4(3H,10H)-dione, 10-((acetyloxy)methyl)-7,8-dimethyl-
  • (7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)methyl acetate
  • (7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2h)-yl)methyl acetate

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
314.30 g/molcalc.
Exact mass
314.1015 Dacalc.
LogP (octanol/water)
0.72calc.
Topological polar surface area
106.9 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
2calc.
Heavy atoms
23calc.
Rings
3calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.27calc.
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=c1nc2[nH]c3ccccc3nc-2c(=O)[nH]1

O=c1nc2[nH]c3ccccc3nc-2c(=O)[nH]1

3 rings, 16 atoms, the Alloxazine ring system.

245 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.

Hydroxymethylflavin suppliers

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Hydroxymethylflavin price

Indicative price range per kg from live supplier offers

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

Frequently asked questions

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

What is Hydroxymethylflavin?

Hydroxymethylflavin is a chemical substance with the molecular formula C15H14N4O4 and a molar mass of 314.30 g/mol. Its CAS registry number is 35847-78-0. The IUPAC name is (7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)methyl acetate.

What is the CAS number of Hydroxymethylflavin?

The CAS registry number of Hydroxymethylflavin is 35847-78-0.

What is the molecular formula and weight of Hydroxymethylflavin?

The molecular formula of Hydroxymethylflavin is C15H14N4O4 and its molar mass is 314.30 g/mol.

What is Hydroxymethylflavin used for?

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

Is Hydroxymethylflavin hazardous?

No GHS hazard classification for Hydroxymethylflavin 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 Hydroxymethylflavin?

Hydroxymethylflavin 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 Hydroxymethylflavin?

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

What is the price of Hydroxymethylflavin?

Suppliers quote Hydroxymethylflavin 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 Hydroxymethylflavin

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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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