HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

O,O-Diethyl S-(((1-methylethyl)thio)methyl) phosphorodithioate

HCID 6541
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
78-52-4
Standard SMILES
CCOP(=S)(OCC)SCSC(C)C
InChIKey
QVSDWRRZCKGXCO-UHFFFAOYSA-N
Molecular formula
C8H19O2PS3
Average molar mass
274.4 g/mol
Monoisotopic mass
274.02848036

Names & identifiers

Preferred name
O,O-Diethyl S-(((1-methylethyl)thio)methyl) phosphorodithioate
IUPAC
diethoxy-(propan-2-ylsulfanylmethylsulfanyl)-sulfanylidene-λ5-phosphane
English name
diethoxy-(propan-2-ylsulfanylmethylsulfanyl)-sulfanylidene-phosphorane
Molecular formula
C8H19O2PS3
Molecular weight
274.404021

Names & synonyms

78-52-4RefChem:1093502O,O-Diethyl S-(((1-methylethyl)thio)methyl) phosphorodithioatePhosphorodithioic acid, O,O-diethyl S-[[(1-methylethyl)thio]methyl] esterExperimental insecticide 12008American cyanamid 12,008ENT 22,865BRN 1708974TM 12008AI3-22865Phosphorodithioic acid, O,O-diethyl S-(((1-methylethyl)thio)methyl) esterO,O-Diethyl S-(isopropylthiomethyl) phosphorodithioate
Show more names
TM-1200TM-12008AC-12008ENT-22865American cyanamid-12008Experimental insecticide-12008diethoxy-(propan-2-ylsulfanylmethylsulfanyl)-sulfanylidene-phosphoranePhosphorodithioic acid,O,O-diethyl S-[[(1-methylethyl)thio]methyl] ester
O,O-Diethyl-S-2-isopropylmercaptomethyl dithiophosphateO,O-Diethyl S-(isopropylmercaptomethyl) phosphorodithioatePhosphorodithioic acid, O,O-diethyl S-((isopropylthio)methyl) esterMethanethiol, (isopropylthio)-, S-ester with O,O-diethyl phosphorodithioateO,O-Diethyl-S-(isopropylthio)methylester kyseliny dithiofosforecne [Czech]DTXSID6075356SCHEMBL29366955O,O-Diethyl-S-(isopropylthio)methylester kyseliny dithiofosforecne

Properties

Computed structural properties

XLogP
4
Topological polar surface area
101 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
14
Formal charge
0
Complexity
177

Physicochemical properties

EPA Substance Registry System
Phosphorodithioic acid, O,O-diethyl S-[[(1-methylethyl)thio]methyl] ester (78-52-4)

Chemistry & industry

Suppliers2 total

Alfa Chemistry+1-5166625404 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
78-52-4
PubChem CID
6541
DTXSID
DTXSID6075356
Nikkaji
J10.506F