Dihlorvos

Dihlorvos
Klinički podaci


Drugs.com	Monografija
Identifikatori
CAS broj	62-73-7^Y
ATCvet kod	QP52AB03 (WHO) QP53AF04
PubChem	CID 3039
ChemSpider	2931^Y
UNII	7U370BPS14^Y
KEGG	D03791^Y
ChEBI	CHEBI:34690^Y
ChEMBL	CHEMBL167911^Y
Hemijski podaci
Formula	C₄H₇Cl₂O₄P
Molarna masa	220,976
SMILES COP(=O)(OC)OC=C(Cl)Cl
InChI InChI=1S/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3^Y Key:OEBRKCOSUFCWJD-UHFFFAOYSA-N^Y

Dihlorvos je organsko jedinjenje, koje sadrži 4 atoma ugljenika i ima molekulsku masu od 220,976 Da.

Osobine

Osobina	Vrednost
Broj akceptora vodonika	4
Broj donora vodonika	0
Broj rotacionih veza	4
Particioni koeficijent^[1] (ALogP)	0,5
Rastvorljivost^[2] (logS, log(mol/L))	-1,4
Polarna površina^[3] (PSA, Å²)	54,6

^ Ghose, A.K.; Viswanadhan V.N. & Wendoloski, J.J. (1998). „Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragment Methods: An Analysis of AlogP and CLogP Methods”. J. Phys. Chem. A. 102: 3762—3772. doi:10.1021/jp980230o.
^ Tetko IV, Tanchuk VY, Kasheva TN, Villa AE (2001). „Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices”. Chem Inf. Comput. Sci. 41: 1488—1493. PMID 11749573. doi:10.1021/ci000392t.
^ Ertl P.; Rohde B.; Selzer P. (2000). „Fast calculation of molecular polar surface area as a sum of fragment based contributions and its application to the prediction of drug transport properties”. J. Med. Chem. 43: 3714—3717. PMID 11020286. doi:10.1021/jm000942e.

Hardman JG, Limbird LE, Gilman AG (2001). Goodman & Gilman's The Pharmacological Basis of Therapeutics (10. изд.). New York: McGraw-Hill. ISBN 0071354697. doi:10.1036/0071422803.
Thomas L. Lemke; David A. Williams, ур. (2007). Foye's Principles of Medicinal Chemistry (6. изд.). Baltimore: Lippincott Willams & Wilkins. ISBN 0781768799.