Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide structure

Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide

TL;DR: Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide (CAS 77508-99-7) is a chemical compound with molecular formula C15H23OPS and molecular weight 282.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-benzylsulfanyl-2,2,3,4,4-pentamethyl-1λ5-phosphetane 1-oxide

Also Known As: 1-benzylsulfanyl-2,2,3,4,4-pentamethyl-1, 2,2,3,4,4-pentamethyl-1-(phenylmethylsulfanyl)-1, Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide, 2,2,3,4,4-Pentamethyl-1-(benzylthio)phosphetane 1-oxide, 1-(benzylsulfanyl)-2,2,3,4,4-pentamethylphosphetan-1-ium-1-olate

CAS: 77508-99-7
Molecular Formula C15H23OPS
Molecular Weight 282.12 g/mol
LogP 3.1
Topological Polar Surface Area 42.4 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 3
Exact Mass 282.12073
Heavy Atoms 18
Complexity 336.0

Chemical Identifiers

CAS Number 77508-99-7
SMILES CC1C(P(=O)(C1(C)C)SCC2=CC=CC=C2)(C)C
InChIKey NEBWINFHBBUSOM-UHFFFAOYSA-N

Product Overview

Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide (CAS 77508-99-7), with molecular formula C15H23OPS and molecular weight 282.12 g/mol. IUPAC: 1-benzylsulfanyl-2,2,3,4,4-pentamethyl-1λ5-phosphetane 1-oxide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide

XLogP
3.1
TPSA (Topological Polar Surface Area)
42.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
18
Complexity
336.0
Exact Mass
282.12073
Monoisotopic Mass
282.12073
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 Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide

The XLogP value of 3.1 indicates that Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide 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 typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide?

The CAS number of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide is 77508-99-7.

What is the molecular formula of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide?

The molecular formula of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide is C15H23OPS.

What is the molecular weight of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide?

The molecular weight of Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide is 282.12 g/mol.

Where can I buy Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide?

You can request a quote for Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide?

Yes, KEHONG BIO provides custom synthesis services for Phosphetane, 2,2,3,4,4-pentamethyl-1-[(phenylmethyl)thio]-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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