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Heterocyclic building blocks

RefChem:313845

Also known as 2-Hydroxy-4,5-dimethyl-2H-1,3,2lambda~5~-dioxaphosphol-2-one

CAS 68005-41-4Formula C4H7O4PMolar mass 150.07 g/mol
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RefChem:313845 chemical structure, C4H7O4P, CAS 68005-41-4
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
68005-41-4
Formula
C4H7O4P
Molar mass
150.07 g/mol
HS code
293499
Category
Heterocyclic building blocks

What is RefChem:313845?

Plain description, key identifiers and synonyms

RefChem:313845 is a chemical substance with the molecular formula C4H7O4P and a molar mass of 150.07 g/mol. Its CAS registry number is 68005-41-4. The IUPAC name is 2-hydroxy-4,5-dimethyl-1,3,2λ5-dioxaphosphole 2-oxide.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-hydroxy-4,5-dimethyl-1,3,2λ5-dioxaphosphole 2-oxide
CAS number
68005-41-4 CAS number cross-checked
Molecular formula
C4H7O4P
InChIKey
XFOGYESPZRDDOF-UHFFFAOYSA-N
InChI
InChI=1S/C4H7O4P/c1-3-4(2)8-9(5,6)7-3/h1-2H3,(H,5,6)
SMILES (canonical and isomeric)
CC1=C(OP(=O)(O1)O)C

Synonyms

  • 2-Hydroxy-4,5-dimethyl-2H-1,3,2lambda~5~-dioxaphosphol-2-one

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
150.07 g/molcalc.
Exact mass
150.0082 Dacalc.
LogP (octanol/water)
1.39calc.
Topological polar surface area
55.76 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
3calc.
Rotatable bonds
0calc.
Heavy atoms
9calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.5calc.
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=[PH]1OC=CO1

O=[PH]1OC=CO1

1 ring, 6 atoms.

7 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.

RefChem:313845 suppliers

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RefChem:313845 price

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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 RefChem:313845 is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for RefChem:313845 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about RefChem:313845, based on the data on this page

What is RefChem:313845?

RefChem:313845 is a chemical substance with the molecular formula C4H7O4P and a molar mass of 150.07 g/mol. Its CAS registry number is 68005-41-4. The IUPAC name is 2-hydroxy-4,5-dimethyl-1,3,2λ5-dioxaphosphole 2-oxide.

What is the CAS number of RefChem:313845?

The CAS registry number of RefChem:313845 is 68005-41-4.

What is the molecular formula and weight of RefChem:313845?

The molecular formula of RefChem:313845 is C4H7O4P and its molar mass is 150.07 g/mol.

What is RefChem:313845 used for?

Known uses and roles of RefChem:313845 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is RefChem:313845 hazardous?

No GHS hazard classification for RefChem:313845 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 RefChem:313845?

RefChem:313845 is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy RefChem:313845?

Post a free request on CompoundList and suppliers of RefChem:313845 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of RefChem:313845?

Suppliers quote RefChem:313845 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 RefChem:313845

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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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