(±)-Coumachlor
Also known as Coumachlor, Tomorin, Ratilan
Key facts
What buyers check first
- Appearance
- Colorless, crystalline solid
- Melting point
- 169 to 171
- Solubility
- In water, 5 mg/l @ 20 °C.
- HS code
- 293220
- Category
- Rodenticides, nematicides and other pesticides

What is (±)-Coumachlor?
Plain description, key identifiers and synonyms
Coumachlor is a hydroxycoumarin.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 3-[1-(4-chlorophenyl)-3-oxobutyl]-4-hydroxychromen-2-one
- CAS number
- 81-82-3 CAS number cross-checked
- EC number
- 201-378-1
- Molecular formula
- C19H15ClO4
- UNII
- UCD8XZW42P
- MDL number
- MFCD00012094
- InChIKey
- DEKWZWCFHUABHE-UHFFFAOYSA-N
- InChI
- InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,22H,10H2,1H3
- SMILES (canonical and isomeric)
- CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O
Synonyms
- Coumachlor
- Tomorin
- Ratilan
- Cumachlor
- Coumachlore
- Cumachloor
- Kumachlor
- Experimental rodenticide 332
- Geigy rodenticide exp. 332
- 3-(1-Acetyl-2-(p-chlorophenyl)ethyl)-4-hydroxycoumarin
- 3-(alpha-Acetonyl-4-chlorobenzyl)-4-hydroxycoumarin
- 3-(alpha-Acetonyl-p-chlorobenzyl)-4-hydroxycoumarin
- 3-(1-(4-Chlorophenyl)-3-oxobutyl)-4-hydroxy-2H-1-benzopyran-2-one
- 3-(1-(4-Chlorophenyl)-3-oxobutyl)-4-hydroxycoumarin
- 4-Hydroxy-3-(1-(4-chlorophenyl)-3-oxobutyl)-2H-1-benzopyran-2-one
- 2H-1-Benzopyran-2-one, 3-[1-(4-chlorophenyl)-3-oxobutyl]-4-hydroxy-
- 3-(alpha-p-Chlorophenyl-beta-acetylethyl)-4-hydroxycoumarin
- 3-[1-(4-Chlorophenyl)-3-oxobutyl]-4-hydroxy-2H-1-benzopyran-2-one
- 2H-1-Benzopyran-2-one, 3-(1-(4-chlorophenyl)-3-oxobutyl)-4-hydroxy-
- 5-18-04-00163 (Beilstein Handbook Reference)
- 3-((alpha-Acetonyl)-4-chlorbenzyl)-4-hydroxycumarin
- Coumarin, 3-(alpha-acetonyl-p-chlorobenzyl)-4-hydroxy-
- (+-)-Coumachlor
- (+/-)-Coumachlor
- 3-(1-(4-Chlorophenyl)-3-oxobutyl)-4-hydroxy-2H-chromen-2-one
Show all 32 synonymsShow fewer synonyms
- 3-[1-(4-chlorophenyl)-3-oxobutyl]-4-hydroxychromen-2-one
- p-Chlorowarfarin
- 3-(1-(4-Chloorfenyl)-3-oxo-butyl)-4-hydroxy-cumarine
- 3-(1-(4-Chlor-phenyl)-3-oxo-butyl)-4-hydroxy-cumarin
- 3-(1-(4-Cloro-fenil)-3-oxo-butil)-4-idrossicumarina
- 3-(1-(4-Chlorophenyl)-3-oxo-butyl)-4-hydroxy-coumarine
- dl-3-(alpha-Acetonyl-4-chlorobenzyl)-4-hydroxycoumarin
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
| Appearance | Colorless, crystalline solidexp.Measured value |
|---|---|
| Melting point | 169 to 171exp.Measured value |
| Solubility | In water, 5 mg/l @ 20 °C.exp.Measured value |
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 | 342.78 g/molcalc.Computed value |
|---|---|
| Exact mass | 342.0659 Dacalc.Computed value |
| LogP (octanol/water) | 4.26calc.Computed value |
| Topological polar surface area | 67.51 Ųcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 4calc.Computed value |
| Heavy atoms | 24calc.Computed value |
| Rings | 3calc.Computed value |
| Aromatic rings | 3calc.Computed value |
| Fraction sp3 carbons | 0.16calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 1calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
O=c1oc2ccccc2cc1Cc1ccccc1
3 rings, 18 atoms, the 3-Benzyl-2H-1-benzopyran-2-one ring system.
221 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H373May cause damage to organs through prolonged or repeated exposure.
- H412Harmful to aquatic life with long lasting effects.
Precautionary statements (4)
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P273Avoid release to the environment.
- P319Get medical help if you feel unwell.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aid(±)-Coumachlor suppliers
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(±)-Coumachlor price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Rodenticide.
Industries and functions
Pharmacological actions
- Anticoagulants
- Rodenticides
How it is made
Preparation: F. Litvan, W. Stoll, US 2648682 (1953 to J. R. Geigy).
Coumachlor is made by the condensation of 3-carbethoxy-4-hydroxycoumarin and p-chlorobenzalacetone.
Regulatory status
Inventories, regulations and trade controls that list this substance
Europe
- EU harmonised classification (CLP Annex VI)Index no: 607-057-00-6
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code (±)-Coumachlor is traded under.
Lactones
- United States14.2%
- India * partner reported13.5%
- Brazil8.5%
* Partner reported figures, a lower bound.
The HS code shown for (±)-Coumachlor is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about (±)-Coumachlor, based on the data on this page
What is (±)-Coumachlor?
What is the CAS number of (±)-Coumachlor?
What is the molecular formula and weight of (±)-Coumachlor?
What is (±)-Coumachlor used for?
Is (±)-Coumachlor hazardous?
What is the HS code of (±)-Coumachlor?
Where can I buy (±)-Coumachlor?
What is the price of (±)-Coumachlor?
Guides for buyers
Practical guides that help when you source, ship or handle (±)-Coumachlor
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
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