CompoundList
Sign in
Phenols

Calcium bis(pentachlorophenolate)

CAS 55868-72-9Formula C12CaCl10O2Molar mass 570.74 g/mol
Get quotes Safety data
Calcium bis(pentachlorophenolate) chemical structure, C12CaCl10O2, CAS 55868-72-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
55868-72-9
Formula
C12CaCl10O2
Molar mass
570.74 g/mol
HS code
290811
Category
Phenols

What is Calcium bis(pentachlorophenolate)?

Plain description, key identifiers and synonyms

Calcium bis(pentachlorophenolate) is a chemical substance with the molecular formula C12CaCl10O2 and a molar mass of 570.74 g/mol. Its CAS registry number is 55868-72-9. The IUPAC name is calcium bis(2,3,4,5,6-pentachlorophenolate).

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
calcium bis(2,3,4,5,6-pentachlorophenolate)
CAS number
55868-72-9 CAS number cross-checked
Molecular formula
C12CaCl10O2
InChIKey
JDUZGPMPCXDJGY-UHFFFAOYSA-L
InChI
InChI=1S/2C6HCl5O.Ca/c2*7-1-2(8)4(10)6(12)5(11)3(1)9;/h2*12H;/q;;+2/p-2
SMILES (canonical and isomeric)
C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[O-].C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)[O-].[Ca+2]

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
570.74 g/molcalc.
Exact mass
565.6409 Dacalc.
LogP (octanol/water)
7.67calc.
Topological polar surface area
46.12 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
0calc.
Heavy atoms
25calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
3calc.
Lipinski rule of five
Fails (2 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, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 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.

Calcium bis(pentachlorophenolate) 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 Calcium bis(pentachlorophenolate) can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Calcium bis(pentachlorophenolate) 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 Calcium bis(pentachlorophenolate) is traded under.

HS 2908.11Indicative HS code

Pentachlorophenol (ISO)

World exports in 2024
$543K
−5.3% vs 2023, imports $382K
2019 to 2024
Top exporters
  1. Netherlands72.3%
  2. France * partner reported12.7%
  3. Italy5.9%
Top importers
  1. France * partner reported37.4%
  2. Germany21.3%
  3. Netherlands13.9%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Calcium bis(pentachlorophenolate), based on the data on this page

What is Calcium bis(pentachlorophenolate)?

Calcium bis(pentachlorophenolate) is a chemical substance with the molecular formula C12CaCl10O2 and a molar mass of 570.74 g/mol. Its CAS registry number is 55868-72-9. The IUPAC name is calcium bis(2,3,4,5,6-pentachlorophenolate).

What is the CAS number of Calcium bis(pentachlorophenolate)?

The CAS registry number of Calcium bis(pentachlorophenolate) is 55868-72-9.

What is the molecular formula and weight of Calcium bis(pentachlorophenolate)?

The molecular formula of Calcium bis(pentachlorophenolate) is C12CaCl10O2 and its molar mass is 570.74 g/mol.

Is Calcium bis(pentachlorophenolate) hazardous?

No GHS hazard classification for Calcium bis(pentachlorophenolate) 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 Calcium bis(pentachlorophenolate)?

Calcium bis(pentachlorophenolate) is usually classified under HS code 290811 (Pentachlorophenol (ISO)). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Calcium bis(pentachlorophenolate)?

Post a free request on CompoundList and suppliers of Calcium bis(pentachlorophenolate) will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Calcium bis(pentachlorophenolate)?

Suppliers quote Calcium bis(pentachlorophenolate) 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 Calcium bis(pentachlorophenolate)

Get quotes for Calcium bis(pentachlorophenolate)

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell this chemical
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 Calcium bis(pentachlorophenolate) 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/calcium-bis-pentachlorophenolate-55868-72-9" title="Calcium bis(pentachlorophenolate) 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 Phenols or HS code 290811

Price on request
Free quotes, contact stays private
Get quotes