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Danifos

HCID 23559
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Basic information

CAS
7173-84-4
Standard SMILES
CCOP(=O)(OCC)SCSc1ccc(Cl)cc1
InChIKey
ZSAZGCBSZUURAX-UHFFFAOYSA-N
Molecular formula
C11H16ClO3PS2
Average molar mass
326.8 g/mol
Monoisotopic mass
325.9967014

Names & identifiers

Preferred name
Danifos
IUPAC
1-chloro-4-(diethoxyphosphorylsulfanylmethylsulfanyl)benzene
English name
Carbophenothion methyl-O-analog
Molecular formula
C11H16ClO3PS2
Molecular weight
326.8

Names & synonyms

Danifos7173-84-4CarbophenoxonBRN 2507642O,O-Diethyl-S-p-chlorophenyl thiomethylphosphorothioateR 1472 (Pesticide)Phosphorothioic acid, S-[[(4-chlorophenyl)thio]methyl] O,O-diethyl esterS-(((p-Chlorophenyl)thio)methyl) O,O-diethyl phosphorothioateDTXSID80221953S-p-Chlorfenylthiomethyl-O,O-diethylester kyseliny thiofosforecneS-p-Chlorfenylthiomethyl-O,O-diethylester kyseliny thiofosforecne [Czech]PHOSPHOROTHIOIC ACID, S-(((p-CHLOROPHENYL)THIO)METHYL) O,O-DIETHYL ESTER
Show more names
PTMPPtmdCarbophenothion O-analogCarbophenothion oxygen analogcarbophenothion oxygen analogueCarbophenothion methyl-O-analog
Phosphorothioic acid, S-[[(p-chlorophenyl)thio]methyl] O,O-diethyl esterR 1472O,O-Diethyl S-(4-chlorophenylthiomethyl) thiophosphateS-(p-Chlorophenylthio)methyl O,O-diethyl phosphorothioateS-([(4-Chlorophenyl)sulfanyl]methyl) o,o-diethyl thiophosphateS-(((4-Chlorophenyl)sulfanyl)methyl) o,o-diethyl thiophosphatePhosphorothioic acid, S-(((4-chlorophenyl)thio)methyl) O,O-diethyl esterRefChem:130865

Database identifiers

CAS
7173-84-4
PubChem CID
23559
DTXSID
DTXSID80221953
UNII
CEZ66K8EMT
Nikkaji
J8.902H

Properties

Computed structural propertiesFilling in

XLogP
3.6
Topological polar surface area
86.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
18
Formal charge
0
Complexity
263

Physicochemical properties

RIDADR
3018 · 3018
HazardClass
6.1 · 6.1(a)
PackingGroup
II

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

ridadr
3018
hazard_class
6.1(a)
packing_group
II

Related reactions

1 records
New reaction record
HRID 1418247 reaction equation
HRID 1418247As reactantuspto-grants-1999_03

Compound notes

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