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1-Oxa-4-thiaspiro[4.5]decane structure
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1-Oxa-4-thiaspiro[4.5]decane

TL;DR: 1-Oxa-4-thiaspiro[4.5]decane (CAS 177-15-1) is a chemical compound with molecular formula C8H14OS and molecular weight 158.07654 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-oxa-4-thiaspiro[4.5]decane

Also Known As: 1-Oxa-4-thiaspiro[4.5]decane, 1-OXA-4-THIASPIRO(4.5)DECANE, C123OCCS1.C2CCCC3, Spiro[cyclohexane-1,2'-[1,3]oxathiolane], Cyclohexanone O,S-ethylenethioacetal

CAS Number
177-15-1
Molecular Formula
C8H14OS
Molecular Weight
158.07654 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1 patents) Heterocyclic Building Blocks (4 patents)

Technical Specifications

Molecular FormulaC8H14OS
Molecular Weight158.07654 g/mol
XLogP2.2
Topological Polar Surface Area (TPSA)34.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds0
Exact Mass158.07654 Da
Heavy Atoms10
Complexity118.0
SMILESC1CCC2(CC1)OCCS2
InChIKeyAWAPQLQRGOLHTD-UHFFFAOYSA-N

Product Description

Applications: 1-Oxa-4-thiaspiro[4.5]decane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-Oxa-4-thiaspiro[4.5]decane (CAS 177-15-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

1-Oxa-4-thiaspiro[4.5]decane (CAS 177-15-1) is a heterocyclic building block with the molecular formula C8H14OS and a molecular weight of 158.08 g/mol. It is also known as 1-Oxa-4-thiaspiro[4.5]decane and 1-OXA-4-THIASPIRO(4.5)DECANE.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 1-Oxa-4-thiaspiro[4.5]decane

XLogP
2.2
TPSA (Topological Polar Surface Area)
34.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
0
Heavy Atoms
10
Complexity
118.0
Exact Mass
158.07654
Monoisotopic Mass
158.07654
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 1-Oxa-4-thiaspiro[4.5]decane

The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Oxa-4-thiaspiro[4.5]decane. With a topological polar surface area (TPSA) of 34.5 Ų, 1-Oxa-4-thiaspiro[4.5]decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Oxa-4-thiaspiro[4.5]decane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 1-Oxa-4-thiaspiro[4.5]decane?

The CAS number of 1-Oxa-4-thiaspiro[4.5]decane is 177-15-1.

What is the molecular formula of 1-Oxa-4-thiaspiro[4.5]decane?

The molecular formula of 1-Oxa-4-thiaspiro[4.5]decane is C8H14OS.

What is the molecular weight of 1-Oxa-4-thiaspiro[4.5]decane?

The molecular weight of 1-Oxa-4-thiaspiro[4.5]decane is 158.07654 g/mol.

What are the applications of 1-Oxa-4-thiaspiro[4.5]decane?

1-Oxa-4-thiaspiro[4.5]decane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...

Where can I buy 1-Oxa-4-thiaspiro[4.5]decane?

You can request a quote for 1-Oxa-4-thiaspiro[4.5]decane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-Oxa-4-thiaspiro[4.5]decane?

Yes, CoreyChem provides custom synthesis services for 1-Oxa-4-thiaspiro[4.5]decane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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