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Butyl palmitate structure
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Butyl palmitate

TL;DR: Butyl palmitate (CAS 111-06-8) is a chemical compound with molecular formula C20H40O2 and molecular weight 312.30283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

棕榈酸丁酯

butyl hexadecanoate

Also Known As: BUTYL PALMITATE, Butyl hexadecanoate, n-Butyl palmitate, Hexadecanoic acid, butyl ester, n-Butyl hexadecanoate

CAS Number
111-06-8
Molecular Formula
C20H40O2
Molecular Weight
312.30283 g/mol
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Application Areas

Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (45 patents) Biotechnology (20 patents) Catalysts (6 patents) Coatings & Adhesives (62 patents) Construction Chemicals (11 patents)

Technical Specifications

Molecular FormulaC20H40O2
Molecular Weight312.30283 g/mol
XLogP8.7
Topological Polar Surface Area (TPSA)26.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds18
Exact Mass312.30283 Da
Heavy Atoms22
Complexity226.0
Vapor Pressure0.0000172 [mmHg]
SMILESCCCCCCCCCCCCCCCC(=O)OCCCC
InChIKeyGLYJVQDYLFAUFC-UHFFFAOYSA-N

Chemical Property Profile of Butyl palmitate

XLogP
8.7
TPSA (Topological Polar Surface Area)
26.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
18
Heavy Atoms
22
Complexity
226.0
Exact Mass
312.30283
Monoisotopic Mass
312.30283
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 Butyl palmitate

The XLogP value of 8.7 indicates that Butyl palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butyl palmitate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl palmitate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Butyl palmitate?

The CAS number of Butyl palmitate is 111-06-8.

What is the molecular formula of Butyl palmitate?

The molecular formula of Butyl palmitate is C20H40O2.

What is the molecular weight of Butyl palmitate?

The molecular weight of Butyl palmitate is 312.30283 g/mol.

Where can I buy Butyl palmitate?

You can request a quote for Butyl palmitate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Butyl palmitate?

Yes, CoreyChem provides custom synthesis services for Butyl palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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