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Heterocyclic building blocks

4-Hydroxymethylphenidate

Also known as p-Hydroxymethylphenidate, para-Hydroxymethylphenidate, threo-DL-p-Hydroxymethylphenidate

CAS 54593-35-0Formula C14H19NO3Molar mass 249.31 g/mol
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4-Hydroxymethylphenidate chemical structure, C14H19NO3, CAS 54593-35-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
54593-35-0
Formula
C14H19NO3
Molar mass
249.31 g/mol
HS code
293339
Category
Heterocyclic building blocks

What is 4-Hydroxymethylphenidate?

Plain description, key identifiers and synonyms

4-Hydroxymethylphenidate is a chemical substance with the molecular formula C14H19NO3 and a molar mass of 249.31 g/mol. Its CAS registry number is 54593-35-0. The IUPAC name is methyl (2S)-2-(4-hydroxyphenyl)-2-[(2S)-piperidin-2-yl]acetate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
methyl (2S)-2-(4-hydroxyphenyl)-2-[(2S)-piperidin-2-yl]acetate
CAS number
54593-35-0
Molecular formula
C14H19NO3
InChIKey
XVXFNANJMMTNSO-STQMWFEESA-N
InChI
InChI=1S/C14H19NO3/c1-18-14(17)13(12-4-2-3-9-15-12)10-5-7-11(16)8-6-10/h5-8,12-13,15-16H,2-4,9H2,1H3/t12-,13-/m0/s1
Canonical SMILES
COC(=O)C(c1ccc(O)cc1)C1CCCCN1
Isomeric SMILES
COC(=O)[C@H]([C@@H]1CCCCN1)C2=CC=C(C=C2)O

Synonyms

  • p-Hydroxymethylphenidate
  • para-Hydroxymethylphenidate
  • threo-DL-p-Hydroxymethylphenidate
  • (S)-(4-Hydroxy-phenyl)-(S)-piperidin-2-yl-acetic acid methyl ester, hydrochloride
  • 2-Piperidineacetic acid, alpha(4-hydroxyphenyl)-, methyl ester, (R*,R*)-(+-)-

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
249.31 g/molcalc.
Exact mass
249.1365 Dacalc.
LogP (octanol/water)
1.79calc.
Topological polar surface area
58.56 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
18calc.
Rings
2calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.5calc.
Formal charge
0calc.
Stereocentres
2calc.
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(CC2CCCCN2)cc1

c1ccc(CC2CCCCN2)cc1

2 rings, 13 atoms, the 2-Benzylpiperidine ring system.

261 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.

4-Hydroxymethylphenidate suppliers

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4-Hydroxymethylphenidate 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 4-Hydroxymethylphenidate 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 4-Hydroxymethylphenidate is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about 4-Hydroxymethylphenidate, based on the data on this page

What is 4-Hydroxymethylphenidate?

4-Hydroxymethylphenidate is a chemical substance with the molecular formula C14H19NO3 and a molar mass of 249.31 g/mol. Its CAS registry number is 54593-35-0. The IUPAC name is methyl (2S)-2-(4-hydroxyphenyl)-2-[(2S)-piperidin-2-yl]acetate.

What is the CAS number of 4-Hydroxymethylphenidate?

The CAS registry number of 4-Hydroxymethylphenidate is 54593-35-0.

What is the molecular formula and weight of 4-Hydroxymethylphenidate?

The molecular formula of 4-Hydroxymethylphenidate is C14H19NO3 and its molar mass is 249.31 g/mol.

What is 4-Hydroxymethylphenidate used for?

Known uses and roles of 4-Hydroxymethylphenidate include building blocks in research and laboratory and screening compounds in research and laboratory.

Is 4-Hydroxymethylphenidate hazardous?

No GHS hazard classification for 4-Hydroxymethylphenidate 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 4-Hydroxymethylphenidate?

4-Hydroxymethylphenidate 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 4-Hydroxymethylphenidate?

Post a free request on CompoundList and suppliers of 4-Hydroxymethylphenidate will send you quotes. Your contact details stay private until you accept a quote.

What is the price of 4-Hydroxymethylphenidate?

Suppliers quote 4-Hydroxymethylphenidate 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 4-Hydroxymethylphenidate

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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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