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Details

Stereochemistry ACHIRAL
Molecular Formula C9H21O2PS2
Molecular Weight 256.366
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-Pentyl-O'-isobutyl dithiophosphate

SMILES

CCCCCOP(S)(=S)OCC(C)C

InChI

InChIKey=KEZYTBRZEHSOTF-UHFFFAOYSA-N
InChI=1S/C9H21O2PS2/c1-4-5-6-7-10-12(13,14)11-8-9(2)3/h9H,4-8H2,1-3H3,(H,13,14)

HIDE SMILES / InChI

Molecular Formula C9H21O2PS2
Molecular Weight 256.366
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 08:58:45 GMT 2025
Edited
by admin
on Wed Apr 02 08:58:45 GMT 2025
Record UNII
NJV7U87PNT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
O-Pentyl-O'-isobutyl dithiophosphate
Common Name English
O-ISOBUTYL O-PENTYL PHOSPHORODITHIOATE
Preferred Name English
PHOSPHORODITHIOIC ACID, O-(2-METHYLPROPYL) O-PENTYL ESTER
Systematic Name English
PHOSPHORODITHIOIC ACID, O-ISOBUTYL O-PENTYL ESTER
Systematic Name English
Code System Code Type Description
CAS
19475-46-8
Created by admin on Wed Apr 02 08:58:45 GMT 2025 , Edited by admin on Wed Apr 02 08:58:45 GMT 2025
PRIMARY
FDA UNII
NJV7U87PNT
Created by admin on Wed Apr 02 08:58:45 GMT 2025 , Edited by admin on Wed Apr 02 08:58:45 GMT 2025
PRIMARY
PUBCHEM
110397
Created by admin on Wed Apr 02 08:58:45 GMT 2025 , Edited by admin on Wed Apr 02 08:58:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID40873997
Created by admin on Wed Apr 02 08:58:45 GMT 2025 , Edited by admin on Wed Apr 02 08:58:45 GMT 2025
PRIMARY
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