CompoundList
Sign in
Alcohols and polyols

Phomoxin C

Also known as (3aR,4S,5R,7aS)-7-[(E)-hept-1-enyl]-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one, (3aR,4S,5R,7aS)-7-((E)-hept-1-enyl)-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one, 1,3-Benzodioxol-2-one, 7-(1E)-1-heptenyl-3a,4,5,7a-tetrahydro-4,5-dihydroxy-6-(hydroxymethyl)-, (3aR,4S,5R,7aS)-rel-(+)-

CAS 873797-24-1Formula C15H22O6Molar mass 298.34 g/mol
Get quotes Safety data
Phomoxin C chemical structure, C15H22O6, CAS 873797-24-1
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
873797-24-1
Formula
C15H22O6
Molar mass
298.34 g/mol
HS code
292090
Category
Alcohols and polyols

What is Phomoxin C?

Plain description, key identifiers and synonyms

Phomoxin C is a carbonate ester.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(3aR,4S,5R,7aS)-7-[(E)-hept-1-enyl]-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one
CAS number
873797-24-1
Molecular formula
C15H22O6
InChIKey
ZDKCZSBZBVIVCB-KWUVHTBZSA-N
InChI
InChI=1S/C15H22O6/c1-2-3-4-5-6-7-9-10(8-16)11(17)12(18)14-13(9)20-15(19)21-14/h6-7,11-14,16-18H,2-5,8H2,1H3/b7-6+/t11-,12+,13+,14-/m1/s1
Canonical SMILES
CCCCCC=CC1=C(CO)C(O)C(O)C2OC(=O)OC12
Isomeric SMILES
CCCCC/C=C/C1=C([C@H]([C@@H]([C@@H]2[C@H]1OC(=O)O2)O)O)CO

Synonyms

  • (3aR,4S,5R,7aS)-7-[(E)-hept-1-enyl]-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one
  • (3aR,4S,5R,7aS)-7-((E)-hept-1-enyl)-4,5-dihydroxy-6-(hydroxymethyl)-3a,4,5,7a-tetrahydro-1,3-benzodioxol-2-one
  • 1,3-Benzodioxol-2-one, 7-(1E)-1-heptenyl-3a,4,5,7a-tetrahydro-4,5-dihydroxy-6-(hydroxymethyl)-, (3aR,4S,5R,7aS)-rel-(+)-

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
298.34 g/molcalc.
Exact mass
298.1416 Dacalc.
LogP (octanol/water)
1.05calc.
Topological polar surface area
96.22 Ųcalc.
Hydrogen bond donors
3calc.
Hydrogen bond acceptors
6calc.
Rotatable bonds
6calc.
Heavy atoms
21calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.67calc.
Formal charge
0calc.
Stereocentres
4calc.
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=C1OC2C=CCCC2O1

O=C1OC2C=CCCC2O1

2 rings, 10 atoms.

2 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.

Phomoxin C suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

No supplier listings yet

Post one free request and suppliers who make or trade Phomoxin C can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Phomoxin C price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

Get latest price

Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

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 Phomoxin C is traded under.

HS 2920.90Indicative HS code

Esters, other than thiophosphoric esters (phosphorothioates) and phosphite esters and their salts…

World exports in 2024
$1.05B
+8.0% vs 2023, imports $1.23B
2019 to 2024
Top exporters
  1. China33.4%
  2. Germany18.8%
  3. United States12.4%
Top importers
  1. United States19.2%
  2. Singapore8.9%
  3. South Korea6.9%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Phomoxin C, based on the data on this page

What is Phomoxin C?

Phomoxin C is a carbonate ester.

What is the CAS number of Phomoxin C?

The CAS registry number of Phomoxin C is 873797-24-1.

What is the molecular formula and weight of Phomoxin C?

The molecular formula of Phomoxin C is C15H22O6 and its molar mass is 298.34 g/mol.

Is Phomoxin C hazardous?

No GHS hazard classification for Phomoxin C 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 Phomoxin C?

Phomoxin C is usually classified under HS code 292090 (Esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Phomoxin C?

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

What is the price of Phomoxin C?

Suppliers quote Phomoxin C 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 Phomoxin C

Get quotes for Phomoxin C

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Phomoxin C
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Phomoxin C with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/phomoxin-c-873797-24-1" title="Phomoxin C structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Alcohols and polyols or HS code 292090

Price on request
Free quotes, contact stays private
Get quotes