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Ethoprophos (~90%)

CAT: 0572-TRC-E890530-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-E890530-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13194-48-4
Synonyms
Ethoprophos
Hazard Statement
Fatal if swallowed; UN number: UN3018; Packing Group: I
Smiles
CCCSP(=O)(OCC)SCCC
Molecular Formula
C8 H19 O2 P S2
Molecular Weight
242.34
InChI
InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3
Additionnal Information
IUPAC name: 1-[ethoxy(propylsulfanyl)phosphoryl]sulfanylpropane
Shipping Conditions
Ice Packs
Storage Conditions
+4°C

Chemical Information

Ethoprophos

Ethoprop can cause cancer according to The Environmental Protection Agency (EPA).

CAS Number13194-48-4
PubChem CID3289
IUPAC Name1-[ethoxy(propylsulfanyl)phosphoryl]sulfanylpropane
Molecular FormulaC8H19O2PS2
Molecular Weight242.3
XLogP3.6
Topological Polar Surface Area76.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count13
Formal Charge0
Complexity152
SMILES
CCCSP(=O)(OCC)SCCC
InChI
InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3
InChIKey
VJYFKVYYMZPMAB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethoprophos
CAS: 13194-48-4
CID: 3289
Formula: C8H19O2PS2
MW: 242.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight242.3
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass242.05640919
Monoisotopic Mass242.05640919
Topological Polar Surface Area76.9 Ų
Heavy Atom Count13
Formal Charge0
Complexity152
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes