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1,2,4-Tributylphosphorotrithioate - analytical standard, high purity , CAS No.78-48-8

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1,2,4-Tributylphosphorotrithioate - analytical standard, high purity , CAS No.78-48-8

1 Citations

COA

Grade & Purity:

analytical standard

Cas Number: 78-48-8
Molecular Weight: 314.51
EC Number: 201-120-8
PubChem CID: 5125

In stock

Item Number

T114221

Grouped product items
SKU	Size	Availability	Price	Qty
T114221-100mg	100mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$420.90

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Analytical standards (133)

Basic Description

Synonyms	Tribufos \| 78-48-8 \| Butifos \| Butyl phosphorotrithioate \| DEF defoliant \| S,S,S-TRIBUTYL PHOSPHOROTRITHIOATE \| Butiphos \| Merphos oxide \| S,S,S-Tributyl trithiophosphate \| Tribuphos \| TBTP \| Phosphorotrithioic acid, S,S,S-tributyl ester \| De-Green \| Fos-Fall A \| E-Z-Off D \| Ortho pho
Specifications & Purity	analytical standard
Storage Temp	Store at 2-8°C,Protected from light
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Grade	analytical standard

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organophosphorus compounds
  - Class Organothiophosphorus compounds

Kingdom	Organic compounds
Superclass	Organophosphorus compounds
Class	Organothiophosphorus compounds
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organothiophosphorus compounds
Alternative Parents	Sulfenyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Sulfenyl compound - Organothiophosphorus compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organothiophosphorus compounds. These are organic derivatives of thiophosphonic acid, thiophosphoric acid, dithiophosphoric acid, or phosphorotrithioic acid, or derivatives thereof. Thiophosphonic acid, dithiophosphoric acid, thiophosphoric acid, and phosphorotrithioic acid are thiophosphorus compounds with the formula OP(O)(=S), OP(S)(=S)O, OP(O)(=S)O, and OP(=S)(S)S, respectively.
External Descriptors	organic thiophosphate
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(Human)

RXRA Tclin Retinoid X receptor alpha (3637 Activities)

Discover Target: RXRA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

Discover Target: SLCO1B1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

Discover Target: SLCO1B3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Tetranychus urticae (2600 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	1-bis(butylsulfanyl)phosphorylsulfanylbutane
INCHI	InChI=1S/C12H27OPS3/c1-4-7-10-15-14(13,16-11-8-5-2)17-12-9-6-3/h4-12H2,1-3H3
InChIKey	ZOKXUAHZSKEQSS-UHFFFAOYSA-N
Smiles	CCCCSP(=O)(SCCCC)SCCCC
Isomeric SMILES	CCCCSP(=O)(SCCCC)SCCCC
WGK Germany	3
RTECS	TG5425000
PubChem CID	5125
UN Number	2811
Packing Group	I
Molecular Weight	314.51

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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1 results found

Lot Number	Certificate Type	Date	Item
J2009248	Certificate of Analysis	Aug 05, 2022	T114221

Chemical and Physical Properties

Sensitivity	Light sensitive
Molecular Weight	314.500 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	12
Exact Mass	314.096 Da
Monoisotopic Mass	314.096 Da
Topological Polar Surface Area	93.000 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	179.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Chao Hu, Cong Zhang, Yi-Fan Tang, Yu-Xi Liu, Zi-Nan Xia, Yan Wang, Wei-Tu Li, Ping Gao, Yu-Ting Li, Yun-Tong Lv, Xue-Qing Yang. (2024) Stability, Inheritance, Cross-Resistance, and Fitness Cost of Resistance to λ-Cyhalothrin in Cydia pomonella. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 72 (42): (23520-23532).

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