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Dibutyl butylphosphonate structure
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Dibutyl butylphosphonate

TL;DR: Dibutyl butylphosphonate (CAS 78-46-6) is a chemical compound with molecular formula C12H27O3P and molecular weight 250.16978 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[butoxy(butyl)phosphoryl]oxybutane

Also Known As: DIBUTYL BUTYLPHOSPHONATE, Dibutyl butanephosphonate, tributylphosphite, Dibutylbutylphosphonate, DBBP compound

CAS Number
78-46-6
Molecular Formula
C12H27O3P
Molecular Weight
250.16978 g/mol
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Application Areas

Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (11 patents) Biotechnology (1 patents) Catalysts (50 patents) Coatings & Adhesives (3 patents) Construction Chemicals (11 patents)

Technical Specifications

Molecular FormulaC12H27O3P
Molecular Weight250.16978 g/mol
XLogP3.2
Topological Polar Surface Area (TPSA)35.5 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors3
Rotatable Bonds11
Exact Mass250.16978 Da
Heavy Atoms16
Complexity181.0
Boiling Point127-128 °C @ 2.5 MM HG
Density0.948 @ 20 °C/4 °C
Flash Point310 °F OC
SolubilityINSOL IN WATER; MISCIBLE WITH MOST COMMON ORG SOLVENTS
SMILESCCCCOP(=O)(CCCC)OCCCC
InChIKeyJPGXOMADPRULAC-UHFFFAOYSA-N

Product Description

Applications: Dibutyl butylphosphonate is used in polymer chemistry and functional materials synthesis, as well as catalysis, accelerating transformations in both laboratory and industrial settings. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dibutyl butylphosphonate (CAS 78-46-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Dibutyl butylphosphonate is a polymer intermediate identified by CAS number 78-46-6 and the molecular formula C12H27O3P and a molecular weight of 250.17 g/mol. Physically, the compound has a density of 0.948 @ 20 °C/4 °C g/cm³, a solubility: INSOL IN WATER; MISCIBLE WITH MOST COMMON ORG SOLVENTS. It is also known as DIBUTYL BUTYLPHOSPHONATE and Dibutyl butanephosphonate.

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 Dibutyl butylphosphonate

XLogP
3.2
TPSA (Topological Polar Surface Area)
35.5
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
3
Rotatable Bonds
11
Heavy Atoms
16
Complexity
181.0
Exact Mass
250.16978
Monoisotopic Mass
250.16978
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 Dibutyl butylphosphonate

The XLogP value of 3.2 indicates that Dibutyl butylphosphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Dibutyl butylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibutyl butylphosphonate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dibutyl butylphosphonate?

The CAS number of Dibutyl butylphosphonate is 78-46-6.

What is the molecular formula of Dibutyl butylphosphonate?

The molecular formula of Dibutyl butylphosphonate is C12H27O3P.

What is the molecular weight of Dibutyl butylphosphonate?

The molecular weight of Dibutyl butylphosphonate is 250.16978 g/mol.

What are the applications of Dibutyl butylphosphonate?

Dibutyl butylphosphonate is used in polymer chemistry and functional materials synthesis, as well as catalysis, accelerating transformations in both laboratory and industrial settings. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Dibutyl...

Where can I buy Dibutyl butylphosphonate?

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

Does CoreyChem offer custom synthesis for Dibutyl butylphosphonate?

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

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