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TPI-1 - 10mM in DMSO, high purity , CAS No.79756-69-7

COA

Grade & Purity:

10mM in DMSO

Cas Number: 79756-69-7
Molecular Weight: 253.08
PubChem CID: 948589

In stock

Item Number

T426054

Grouped product items
SKU	Size	Availability	Price	Qty
T426054-1ml	1ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$367.90

phosphatase Inhibitors

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Compound libraries (12325) Glucose Metabolism (1943)

Basic Description

Synonyms	tpi-1 \| 79756-69-7 \| 2-(2,5-dichlorophenyl)cyclohexa-2,5-diene-1,4-dione \| 2',5'-Dichloro-[1,1'-biphenyl]-2,5-dione \| TPI 1 \| 2,5-Cyclohexadiene-1,4-dione, 2-(2,5-dichlorophenyl)- \| 2-(2,5-dichlorophenyl)-2,5-cyclohexadiene-1,4-dione \| CBMicro_042121 \| 2-(2,5-Dichlorophe
Specifications & Purity	10mM in DMSO
Biochemical and Physiological Mechanisms	TPI-1 (Tyrosine Phosphatase Inhibitor 1) is a potent inhibitor of SHP-1 with IC50 of 40 nM for recombinant SHP-1. TPI-1 exhibits anticancer activity.
Storage Temp	Store at -80°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Information TPI-1 TPI-1 (Tyrosine Phosphatase Inhibitor 1) is a potent inhibitor of SHP-1 with IC50 of 40 nM for recombinant SHP-1. TPI-1 exhibits anticancer activity. Targets SHP-1 (Cell-free assay) 40 nM

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Halobenzenes
      - Level5 Chlorobenzenes
        Level6 Dichlorobenzenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Halobenzenes
Intermediate Tree Nodes	Chlorobenzenes
Direct Parent	Dichlorobenzenes
Alternative Parents	P-benzoquinones Aryl chlorides Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Quinone - P-benzoquinone - 1,4-dichlorobenzene - Aryl halide - Aryl chloride - Cyclic ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors	Not available
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

Names and Identifiers

IUPAC Name	2-(2,5-dichlorophenyl)cyclohexa-2,5-diene-1,4-dione
INCHI	InChI=1S/C12H6Cl2O2/c13-7-1-3-11(14)9(5-7)10-6-8(15)2-4-12(10)16/h1-6H
InChIKey	ZKHFYORNAYYOTM-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1Cl)C2=CC(=O)C=CC2=O)Cl
Isomeric SMILES	C1=CC(=C(C=C1Cl)C2=CC(=O)C=CC2=O)Cl
PubChem CID	948589
Molecular Weight	253.08

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	117 - 118 °C
Molecular Weight	253.080 g/mol
XLogP3	2.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	251.974 Da
Monoisotopic Mass	251.974 Da
Topological Polar Surface Area	34.100 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	384.000
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

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