Salithion

dioxabenzophos · DIOXABENZOFOS · Salibal · Salibassa · Salithion · Fenfosphorin · ioxabenzofos · FENPHOSPHORIN

Identifikatoren & physikalische Daten

CAS No.	3811-49-2
Summenformel	C8H9O3PS
Durchschnittliche Molmasse	216,2 g/mol
Monoisotopische Masse	216,00100232 g/mol
SMILES	COP1(=S)OCc2ccccc2O1
InChIKey	OUNSASXJZHBGAI-UHFFFAOYSA-N
PubChem CID	19657
ChEMBL	CHEMBL226967
ChEBI	CHEBI:82120
EC No.	223-292-3
DTXSID	DTXSID7041885
Lokaler Name	Salithion

XLogP	2,7
Polarare Oberfläche (TPSA)	59,8
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	1
Schwere Atome	13
Formalladung	0
Komplexität	233
Kovats Retention Index	1600160916451663.915931633.5162516722674
Schmelzpunkt	55-56℃ (methanol )
Siedepunkt	approximate 274℃
Dichte	1.37±0.1 g/cm3(Predicted)
Lagerbedingungen	0-6°C
Löslichkeit	58mg/L(30 ºC)
BRN	1875270
Henry-Konstante	4.7×10-1 mol/(m3Pa) at 25℃, MacBean (2012)
InChI	1S/C8H9O3PS/c1-9-12(13)10-6-7-4-2-3-5-8(7)11-12/h2-5H,6H2,1H3
InChIKey	OUNSASXJZHBGAI-UHFFFAOYSA-N
SMILES	COP1(=S)OCc2ccccc2O1
EPA chemische Informationen	Dioxabenzofos (3811-49-2)

GHS-Einstufung	DangerH301: Toxic if swallowed [Danger Acute toxicity, oral]H311: Toxic in contact with skin [Danger Acute toxicity, dermal]H370 **: Causes damage to organs [Danger Specific target organ toxicity, single exposure]H411: Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P260, P262, P264, P270, P273, P280, P301+P316, P302+P352, P308+P316, P316, P321, P330, P361+P364, P391, P405, and P501 (click each P-code to see the statement)
DOT Hazard Classification	SalithionMarine pollutant
Hazard Classes and Categories	Acute Tox. 3 (100%)Acute Tox. 3 (97.5%)STOT SE 1 (97.5%)Aquatic Chronic 2 (100%)Acute toxicity - category 3Specific target organ toxicity (single exposure) - category 1Hazardous to the aquatic environment (chronic) - category 2Acute toxicity (Oral) - Category 3Acute toxicity (Dermal) - Category 3Acute Tox. 3 *Aquatic Chronic 2
Wassergefährdungsklasse (WGK)	3
UN-Transportnummer	2783
Zollcode	29349990
R-Sätze (R)	24/25-39/25-51/53
Toxizität	chicken,LD50,oral,110mg/kg (110mg/kg),PERIPHERAL NERVE AND SENSATION: STRUCTURAL CHANGE IN NERVE OR SHEATHBEHAVIORAL: ATAXIA,Bochu Kagaku. Scientific Pest Control. Vol. 40, Pg. 49, 1975.
Gefahrensymbole	T,N
Sicherheitshinweise (S)	36/37-38-45-61
Gefahrenklasse	6.1(b)Acute Tox. 3 OralAcute Tox. 4 DermalAquatic Chronic 2
Verpackungsgruppe	III