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1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine structure
Fine Chemical

1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine

TL;DR: 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine (CAS 85966-90-1) is a chemical compound with molecular formula C28H56NO7P and molecular weight 549.37946 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2-acetyloxy-3-octadec-9-enoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate

Also Known As: PAF C-18:1, 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine, Dehydro-PAF (C);1-O-Oleyl-2-O-acetyl-sn-glycero-3-phosphocholine, (2-acetyloxy-3-octadec-9-enoxypropyl) 2-(trimethylazaniumyl)ethyl phosphate, 2-(acetyloxy)-3-(octadec-9-en-1-yloxy)propyl 2-(trimethylammonio)ethyl phosphate

CAS Number
85966-90-1
Molecular Formula
C28H56NO7P
Molecular Weight
549.37946 g/mol
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Technical Specifications

Molecular FormulaC28H56NO7P
Molecular Weight549.37946 g/mol
XLogP6.7
Topological Polar Surface Area (TPSA)94.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors7
Rotatable Bonds27
Exact Mass549.37946 Da
Heavy Atoms37
Complexity614.0
SMILESCCCCCCCCC=CCCCCCCCCOCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)C
InChIKeyZBOQHUSCQCEBGK-UHFFFAOYSA-N

Product Description

Applications: 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine (CAS 85966-90-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

A fine chemical supplied by CoreyChem, 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine (CAS 85966-90-1) has the molecular formula C28H56NO7P and a molecular weight of 549.38 g/mol. It is also known as PAF C-18:1 and 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine.

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-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine

XLogP
6.7
TPSA (Topological Polar Surface Area)
94.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
27
Heavy Atoms
37
Complexity
614.0
Exact Mass
549.37946
Monoisotopic Mass
549.37946
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-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine

The XLogP value of 6.7 indicates that 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine. Following Lipinski's Rule of Five, 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

The CAS number of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is 85966-90-1.

What is the molecular formula of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

The molecular formula of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is C28H56NO7P.

What is the molecular weight of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

The molecular weight of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is 549.37946 g/mol.

What are the applications of 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine (CAS 85966-90-1) with...

Where can I buy 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

You can request a quote for 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine?

Yes, CoreyChem provides custom synthesis services for 1-O-(cis-9-Octadecenyl)-2-O-acetyl-sn-glycero-3-phosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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