Chemical Properties of Coumaphos (CAS 56-72-4)

InChI

InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3

InChI Key

BXNANOICGRISHX-UHFFFAOYSA-N

Formula

C14H16ClO5PS

SMILES

CCOP(=S)(OCC)Oc1ccc2c(C)c(Cl)c(=O)oc2c1

Molecular Weight¹

362.77

CAS

56-72-4

Other Names

3-Chloro-4-methyl-7-coumarinyl diethyl phosphorothioate
3-Chloro-4-methyl-7-hydroxycoumarin diethyl thiophosphoric acid ester
3-Chloro-4-methylumbelliferone O-ester with O,O-diethyl phosphorothioate
3-Chloro-7-hydroxy-4-methyl-coumarin O,O-diethyl phosphorothioate
3-Chloro-7-hydroxy-4-methyl-coumarin O-ester with O,O-diethyl phosphorothioate
3-chloro-7-diethoxyphosphinothioyloxy-4-methylchromen-2-one
Agridip
Asunthol
Asuntol
Azunthol
BAY 21/199
Bayer 21/199
Baymix
Baymix 50
Co-ral
Co-ral (Coumaphos)
Co-ral (phosphate)
Coumafos
Coumarin, 3-chloro-7-hydroxy-4-methyl-, O-ester with O,O-diethyl phosphorothioate
Cumafos
Diethyl 3-chloro-4-methylumbelliferyl thionophosphate
Diethyl thiophosphoric acid ester of 3-chloro-4-methyl-7-hydroxycoumarin
Diolice
ENT 17,957
Koral
Meldane
Meldone
Muscatox
NA 2783
NCI-C08662
Negashunt
O,O-Diaethyl-O-(3-chlor-4-methyl-cumarin-7-yl)-monothiophosphat
O,O-Diethyl 3-chloro-4-methyl-7-umbelliferone thiophosphate
O,O-Diethyl O-(3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl)phosphorothioate
O,O-Diethyl O-(3-chloro-4-methyl-2-oxo-2H-benzopyran-7-yl)phosphorothioate
O,O-Diethyl O-(3-chloro-4-methyl-7-coumarinyl)phosphorothioate
O,O-Diethyl O-(3-chloro-4-methylcoumarinyl-7) thiophosphate
O,O-Diethyl O-(3-chloro-4-methylumbelliferyl)phosphorothioate
O,O-Diethyl-O-(3-chloor-4-methyl-cumarin-7-yl)monothiofosfaat
O,O-Diethyl-O-(3-chloro-4-methyl-cumarin-7-yl)monothiofosfaat
O,O-Dietil-O-(3-chloro-4-metil-cumarin-7-il-monotiofosfato)
O,O-Dietil-O-(3-cloro-4-metil-cumarin-7-il-monotiofosfato)
O-(3-Chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl) O,O-diethyl phosphorothioate
O-(3-Chloro-4-methylcoumarin-7-yl) O,O-diethyl phosphorothioate
O-3-Chloro-4-methyl-7-coumarinyl O,O-diethyl phosphorothioate
OMS 485
Perizin
Phosphorothioic acid, O,O-diethyl ester, O-ester with 3-chloro-7-hydroxy-4-methylcoumarin
Phosphorothioic acid, O-(3-chloro-4-methyl-2-oxo-2H-1-benzopyran-7-yl) O,O-diethyl ester
Resistox
Resitox
Suntol
Thiophosphate de O,O-diethyle et de O-(3-chloro-4-methyl-7-coumarinyle)
Umbethion

log₁₀WS : Log10 of Water solubility in mol/l.
logP_oct/wat : Octanol/Water partition coefficient.
McVol : McGowan's characteristic volume (ml/mol).
I_np : Non-polar retention indices.
T_fus : Normal melting (fusion) point (K).
¹: Molecular weight from the IUPAC atomic weights tables.

Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Please note that you need to enable javascript to get access to all the properties. Here is how to do it for Internet Explorer and for Firefox.

Physical Properties

Property	Value	Unit	Source
log₁₀WS	[-5.62; -5.38]
log₁₀WS	-5.62		Aq. Sol...
log₁₀WS	-5.38		Estimat...
logP_oct/wat	4.431		Crippen Calculated Property
McVol	243.300	ml/mol	McGowan Calculated Property
I_np	[2654.00; 2654.00]
I_np	2654.00		NIST
I_np	2654.00		NIST
T_fus	368.40 ± 0.10	K	NIST

Similar Compounds

Find more compounds similar to Coumaphos.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.