Dimethyl-bisphenol A - ≥99% , CAS No.1568-83-8

CAS: 1568-83-8 Cat. No.: D275158 Molecular Weight: 256.34

GRADE & PURITY ≥99%

Synonyms

HIF-1alpha inhibitor | KSC-7-226 | BISPHENOLADIMETHYLETHER | DTXSID30347091 | 1-methoxy-4-[2-(4-methoxyphenyl)propan-2-yl]benzene | MFCD00984727 | OJYIBEYSBXIQOP-UHFFFAOYSA-N | 1-Methoxy-4-[1-(4-methoxyphenyl)-1-methylethyl]benzene # | HY-115746 | AKOS003

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Specifications

Synonyms

HIF-1alpha inhibitor | KSC-7-226 | BISPHENOLADIMETHYLETHER | DTXSID30347091 | 1-methoxy-4-[2-(4-methoxyphenyl)propan-2-yl]benzene | MFCD00984727 | OJYIBEYSBXIQOP-UHFFFAOYSA-N | 1-Methoxy-4-[1-(4-methoxyphenyl)-1-methylethyl]benzene # | HY-115746 | AKOS003

Specifications & Purity

≥99%

Biochemical and Physiological Mechanisms

HIF-1α inhibitor that promotes degradation of HIF-1α protein by dissociating Hsp90 from HIF-1α. Inhibits steroidogenesis and down regulates rate-limiting enzymes (StAR) in the estradiol biosynthesis pathway.Dimethyl-bisphenol A (DMBPA) is a potent HIF-1α

Storage

Store at -20°C, Desiccated

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 504759558
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759558
• Canonical Smiles: CC(C)(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC
• IUPAC Name: 1-methoxy-4-[2-(4-methoxyphenyl)propan-2-yl]benzene
• InChIKey: OJYIBEYSBXIQOP-UHFFFAOYSA-N
• INCHI: 1S/C17H20O2/c1-17(2,13-5-9-15(18-3)10-6-13)14-7-11-16(19-4)12-8-14/h5-12H,1-4H3
• Isomeric SMILES: CC(C)(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC
• Molecular Weight: 256.34
• Reaxy-Rn: 1879104
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1879104&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Diphenylmethanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Phenylpropanes Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Phenylpropane - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• External Descriptors: Not available

Data sources

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

Chemical and Physical Properties

• Solubility: Soluble in ethanol to 75 mM and in DMSO to 100 mM
• Molecular Weight: 256.339 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 256.146 Da
• Monoisotopic Mass: 256.146 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 232.000
• 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

References

1. Xiaoye Cheng, Yijin Jiang, Xu Zhao, Nana Ma, Xiangzhen Shen.  (2024)  Regulation of lactate accumulation in bovine mammary epithelial cells by LPS-induced HIF-1α/MCT1 pathway.  MICROBIAL PATHOGENESIS,      [PMID:39725042] [10.1016/j.micpath.2024.107261]