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Structure

Isodecyl isoundecyl phthalate

CAS
94979-22-3
Catalog Number
ACM94979223
Category
Other Products
Molecular Weight
460.689020 [g/mol]
Molecular Formula
C29H48O4

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Specification

Synonyms
Isodecyl isoundecyl phthalate, EINECS 305-701-8, 94979-22-3
IUPAC Name
1-O-(9-methyldecyl) 2-O-(8-methylnonyl) benzene-1,2-dicarboxylate
Canonical SMILES
CC(C)CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C
InChI Key
JDIWRCVIEKCANJ-UHFFFAOYSA-N
EC Number
305-701-8
Exact Mass
460.35500
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular weight of Isodecyl isoundecyl phthalate?

The molecular weight of Isodecyl isoundecyl phthalate is 460.7 g/mol.

What is the IUPAC name of Isodecyl isoundecyl phthalate?

The IUPAC name of Isodecyl isoundecyl phthalate is 1-O-(9-methyldecyl) 2-O-(8-methylnonyl) benzene-1,2-dicarboxylate.

What is the Canonical SMILES representation of Isodecyl isoundecyl phthalate?

The Canonical SMILES representation of Isodecyl isoundecyl phthalate is CC(C)CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC(C)C.

How many hydrogen bond acceptors does Isodecyl isoundecyl phthalate have?

Isodecyl isoundecyl phthalate has 4 hydrogen bond acceptors.

What is the XLogP3 value of Isodecyl isoundecyl phthalate?

The XLogP3 value of Isodecyl isoundecyl phthalate is 11.2.

What is the topological polar surface area of Isodecyl isoundecyl phthalate?

The topological polar surface area of Isodecyl isoundecyl phthalate is 52.6 Å2.

How many rotatable bonds does Isodecyl isoundecyl phthalate have?

Isodecyl isoundecyl phthalate has 21 rotatable bonds.

Is Isodecyl isoundecyl phthalate a covalently-bonded unit?

Yes, Isodecyl isoundecyl phthalate is a covalently-bonded unit.

What is the CAS number of Isodecyl isoundecyl phthalate?

The CAS number of Isodecyl isoundecyl phthalate is 94979-22-3.

What is the exact mass of Isodecyl isoundecyl phthalate?

The exact mass of Isodecyl isoundecyl phthalate is 460.35526001 g/mol.

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