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Structure

Didecyl phthalate

CAS
84-77-5
Catalog Number
ACM84775-1
Category
Other Products
Molecular Weight
446.7
Molecular Formula
C28H46O4

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Specification

Synonyms
Di-N-decyl phthalate
IUPAC Name
Didecyl benzene-1,2-dicarboxylate
Canonical SMILES
CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC
InChI
InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3
InChI Key
PGIBJVOPLXHHGS-UHFFFAOYSA-N
Boiling Point
261 °C
Melting Point
4 °C
Flash Point
232 °C
Density
0.97 g/mL
Complexity
420
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
446.33960994
Formal Charge
0
Heavy Atom Count
32
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
446.33960994
Physical State
Liquid
Rotatable Bond Count
22
Safety Description
24/25
Topological Polar Surface Area
52.6 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
July 19, 2023


Work good in chromatographic analysis
As a gas chromatographic stationary liquid, didecyl phthalate can improve the separation efficiency of specific compounds.

What is the molecular formula of Didecyl phthalate?

The molecular formula of Didecyl phthalate is C28H46O4.

What is the molecular weight of Didecyl phthalate?

The molecular weight of Didecyl phthalate is 446.7 g/mol.

What are some synonyms for Didecyl phthalate?

Some synonyms for Didecyl phthalate are DIDECYL PHTHALATE, Di-n-decyl phthalate, Decyl phthalate, and Vinicizer 105.

When was Didecyl phthalate created and last modified?

Didecyl phthalate was created on 2005-03-26 and last modified on 2023-12-30.

What is the IUPAC Name of Didecyl phthalate?

The IUPAC Name of Didecyl phthalate is didecyl benzene-1,2-dicarboxylate.

What is the InChI of Didecyl phthalate?

The InChI of Didecyl phthalate is InChI=1S/C28H46O4/c1-3-5-7-9-11-13-15-19-23-31-27(29)25-21-17-18-22-26(25)28(30)32-24-20-16-14-12-10-8-6-4-2/h17-18,21-22H,3-16,19-20,23-24H2,1-2H3.

What is the Canonical SMILES of Didecyl phthalate?

The Canonical SMILES of Didecyl phthalate is CCCCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCCCC.

What is the CAS number of Didecyl phthalate?

The CAS number of Didecyl phthalate is 84-77-5.

What is the XLogP3 value of Didecyl phthalate?

The XLogP3 value of Didecyl phthalate is 11.2.

How many hydrogen bond acceptor counts does Didecyl phthalate have?

Didecyl phthalate has 4 hydrogen bond acceptor counts.

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