rac-Coumachlor | CAS No. 81-82-3

rac-Coumachlor

Basic Information

CAS Number

81-82-3

Molecular Formula

C19H15ClO4

Molecular Weight

342.8 g/mol

AD

Basic Physical Properties

Melting Point

168-170 °C

Boiling Point

543.108 °C at 760 mmHg

Density

1.2972 (estimate)

Flash Point

543.108 °C at 760 mmHg

Solubility

acetone: soluble

Refractive Index

1.641

CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O

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

InChIKey

DEKWZWCFHUABHE-UHFFFAOYSA-N

LogP

4.263000000000004

Topological Polar Surface Area

67.51 Ų

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

534

Safety Information

View Safety Information

GHS Hazard Pictograms

H373H373
H412

Hazard Statement

H373 Causes damage to organs through prolonged or repeated exposure
Specific target organ toxicity, repeated exposure
H412 Harmful to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class 6.1(a) Class 6.1(a)

Toxicity

MLD in dog, swine (mg/kg): <5, <5 orally (Wanntorp)

Synonyms & References

English

  • 3-(1-(4-Chlorophenyl)-3-oxobutyl)-4-hydroxy-2H-chromen-2-one
  • BRN 1689759
  • Coumachlore
  • UCD8XZW42P
  • MFCD00012094
  • SCHEMBL433455
  • Cumachlor
  • 3-[1-(4-chlorophenyl)-3-oxobutyl]-4-hydroxychromen-2-one
  • 3-(.alpha.-p-Chlorophenyl-.beta.-acetylethyl)-4-hydroxycoumarin
  • COUMACHLOR [ISO]
  • (.+/-.)-Coumachlor
  • 3-(1-(4-Cloro-fenil)-3-oxo-butil)-4-idrossicumarina
  • 3-((.ALPHA.-ACETONYL)-4-CHLORBENZYL)-4-HYDROXYCUMARIN [HSDB]
  • Coumarin, 3-(alpha-acetonyl-p-chlorobenzyl)-4-hydroxy-
  • CS-W013916
  • Kumachlor [Czech]
  • 3-(1-(P-CHLOROPHENYL)-2-ACETYLETHYL)-4-HYDROXYCOUMARIN
  • Ratilan
  • G-23133
  • EINECS 201-378-1
  • 3-(alpha-Acetonyl-p-chlorobenzyl)-4-hydroxycoumarin
  • 4-Hydroxy-3-[3-oxo-1-(4-chlorophenyl)butyl]coumarin
  • 3-(.ALPHA.-ACETONYL-4-CHLOROBENZYL)-4-HYDROXY COUMARIN, (+/-)-
  • Coumachlor, PESTANAL(R), analytical standard
  • 3-(1-(4-Chlorophenyl)-3-oxo-butyl)-4-hydroxy-coumarine
  • Famarin
  • Coumachlore [French]
  • FT-0631370
  • COUMACHLOR, (+/-)-
  • AC-22308
  • AKOS015962273

MDL Number

MFCD00012094

Related Compounds

You might also like

Compound Q&A

What is 6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one (CAS: 21889-89-4)?

6-Methyl-7-oxabicyclo[4.1.0]heptan-2-one is a cyclic ketone with a molecular for...

21889-89-46-Methyl-7-oxabicycl...
Compound Q&A

What is 4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid (CAS: 906353-00-2)?

4-[(6-Methyl-2-pyrazinyl)oxy]benzoic acid is a chemical compound with the CAS nu...

906353-00-24-[(6-Methyl-2-pyraz...
Compound Q&A

What is 2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8)?

2-(2-Pyridinyl)-1,3-propanediol (CAS: 49745-42-8) is a colorless to slightly yel...

49745-42-82-(2-Pyridinyl)-1,3-...
Compound Q&A

What is 2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile (CAS: 24783-42-4)?

2-(6-Chloro-2-pyridinyl)-2-phenylacetonitrile is an organic compound with the CA...

24783-42-42-(6-Chloro-2-pyridi...
Compound Q&A

What is 2-Oxopropanamide (CAS: 631-66-3)?

2-Oxopropanamide, also known as 2-aminoacrylic acid, is a chemical compound with...

631-66-32-Oxopropanamide
Compound Q&A

What is 2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CAS: 1289040-88-5)?

2-Methyl-2-propanyl 4-(5-bromo-6-methyl-2-pyridinyl)-1-piperazinecarboxylate (CA...

1289040-88-52-Methyl-2-propanyl ...
Compound Q&A

What is NAMPT inhibitor-linker 1 (CAS: 2241019-57-6)?

NAMPT inhibitor-linker 1 (CAS: 2241019-57-6) is a chemical compound designed as ...

2241019-57-6NAMPT inhibitor-link...
Compound Q&A

What is (2-(2,2,2-Trifluoroacetyl)pyridin-4-yl)boronic acid (CAS: 1310404-58-0)?

It is a chemical compound with the structure (2-(2,2,2-Trifluoroacetyl)pyridin-4...

1310404-58-0(2-(2,2,2-Trifluoroa...
Compound Q&A

What is 1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one (CAS: 794568-90-4)?

1-(2-Chlorophenyl)-6-(3,3,3-trifluoro-2-methylpropyl)-1,5-dihydro-4H-pyrazolo[3,...

794568-90-41-(2-Chlorophenyl)-6...
Compound Q&A

What is Vinyl(chloromethyl)dimethoxysilane (CAS: 1314981-48-0)?

Vinyl(chloromethyl)dimethoxysilane is an organosilicon compound with the molecul...

1314981-48-0Vinyl(chloromethyl)d...