O,O-Bis(4-tert-pentylphenyl) hydrogen dithiophosphate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H31O2PS2
Molecular Weight	422.584
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of O,O-Bis(4-tert-pentylphenyl) hydrogen dithiophosphate

Structure Search

SMILES

CCC(C)(C)C1=CC=C(OP(S)(=S)OC2=CC=C(C=C2)C(C)(C)CC)C=C1

InChI

InChIKey=XYUOERDTMNFHKR-UHFFFAOYSA-N

InChI=1S/C22H31O2PS2/c1-7-21(3,4)17-9-13-19(14-10-17)23-25(26,27)24-20-15-11-18(12-16-20)22(5,6)8-2/h9-16H,7-8H2,1-6H3,(H,26,27)

HIDE SMILES / InChI

Molecular Formula	C22H31O2PS2
Molecular Weight	422.584
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 `Tue Apr 01 19:37:40 GMT 2025` Edited by `admin` on `Tue Apr 01 19:37:40 GMT 2025`
Record UNII	QGH58JN7V8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-66319

Preferred Name

English

O,O-Bis(4-tert-pentylphenyl) hydrogen dithiophosphate

Systematic Name

English

Phenol, 4-(1,1-dimethylpropyl)-, hydrogen phosphorodithioate

Systematic Name

English

NSC-402574

Code

English

Code System Code Type Description

CAS

2522-17-0

Created by admin on Tue Apr 01 19:37:40 GMT 2025 , Edited by admin on Tue Apr 01 19:37:40 GMT 2025

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EPA CompTox

DTXSID40179880

Created by admin on Tue Apr 01 19:37:40 GMT 2025 , Edited by admin on Tue Apr 01 19:37:40 GMT 2025

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PUBCHEM

248831

Created by admin on Tue Apr 01 19:37:40 GMT 2025 , Edited by admin on Tue Apr 01 19:37:40 GMT 2025

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FDA UNII

QGH58JN7V8

Created by admin on Tue Apr 01 19:37:40 GMT 2025 , Edited by admin on Tue Apr 01 19:37:40 GMT 2025

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NSC

66319

Created by admin on Tue Apr 01 19:37:40 GMT 2025 , Edited by admin on Tue Apr 01 19:37:40 GMT 2025

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