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Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] structure
Fine Chemical

Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]

TL;DR: Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] (CAS 156547-71-6) is a chemical compound with molecular formula C11H8O2S2 and molecular weight 235.99657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

spiro[1,3-dioxolane-2,7'-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene]

Also Known As: spiro[1,3-dioxolane-2,5'-[?]], NCI60_027888, J1.627.643J, Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane], Spiro[4H-cyclopenta[2,1-b:3,4-b]dithiophene-4,2-[1,3]dioxolane]

CAS Number
156547-71-6
Molecular Formula
C11H8O2S2
Molecular Weight
235.99657 g/mol
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Technical Specifications

Molecular FormulaC11H8O2S2
Molecular Weight235.99657 g/mol
XLogP2.0
Topological Polar Surface Area (TPSA)74.9 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds0
Exact Mass235.99657 Da
Heavy Atoms15
Complexity256.0
SMILESC1COC2(O1)C3=C(C4=C2C=CS4)SC=C3
InChIKeyBCGOAEVQIBPZCC-UHFFFAOYSA-N

Chemical Property Profile of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]

XLogP
2.0
TPSA (Topological Polar Surface Area)
74.9
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
15
Complexity
256.0
Exact Mass
235.99657
Monoisotopic Mass
235.99657
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]

The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]. Following Lipinski's Rule of Five, Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]?

The CAS number of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] is 156547-71-6.

What is the molecular formula of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]?

The molecular formula of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] is C11H8O2S2.

What is the molecular weight of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]?

The molecular weight of Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] is 235.99657 g/mol.

Where can I buy Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]?

You can request a quote for Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane]?

Yes, CoreyChem provides custom synthesis services for Spiro[cyclopenta[2,1-b:3,4-b']dithiophene-4,2'-[1,3]dioxolane] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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