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Phosphorodichloridodithioic acid, propyl ester

HCID 79347
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5390-61-4
Standard SMILES
CCCSP(=S)(Cl)Cl
InChIKey
LYNQYRBGWINIFJ-UHFFFAOYSA-N
Molecular formula
C3H7Cl2PS2
Average molar mass
209.1 g/mol
Monoisotopic mass
207.910385

Names & identifiers

Preferred name
Phosphorodichloridodithioic acid, propyl ester
IUPAC
dichloro-propylsulfanyl-sulfanylidene-λ5-phosphane
English name
propyl dichlorodithiophosphate
Molecular formula
C3H7Cl2PS2
Molecular weight
209.1

Names & synonyms

Propyl phosphorodichloridodithioate5390-61-4Phosphorodichloridodithioic acid, propyl esterEINECS 226-385-7DTXSID9063823RefChem:173865DTXCID30415342,6-DIAMINO-1,6-DIHYDROPYRIMIDINE-4,5-DIONEPropyl dichlorodithiophosphateSCHEMBL8943282LYNQYRBGWINIFJ-UHFFFAOYSA-NNS00044187
Show more names
S-PROPYL DITHIOPHOSPHORYL DICHLORIDE(Propylthio)dichlorophosphine sulfide2,4-diamino-1,4-dihydropyrimidine-5,6-dionePhosphorodichloridodithioic acid propyl ester

Database identifiers

CAS
5390-61-4
PubChem CID
79347
DTXSID
DTXSID9063823
EC Number
226-385-7
Nikkaji
J217.940G

Properties

Computed structural properties

XLogP
4
Topological polar surface area
57.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
8
Formal charge
0
Complexity
99.5

Physicochemical properties

Boiling point
60 · 60-61 °C(Press: 0.1 Torr)
Density
1.3626 g/cm3 · 1.3626 g/cm3
EPA Substance Registry System
Phosphorodichloridodithioic acid, propyl ester (5390-61-4)
TSCA
TSCA listed

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

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPhosphorodichloridodithioic acid, propyl ester: ACTIVE

Upstream & downstream products

Upstream raw materials

Thiophosphoryl chloride1-Propanethiol

Downstream products

O-ethyl S-propyl chlorodithiophosphate

Suppliers2 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
湖北万业众诚化学试剂有限责任公司18671296875 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes