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Structure

Bis-(nonylphenyl)glutarate

CAS
93982-12-8
Catalog Number
ACM93982128
Category
Other Products
Molecular Weight
536.784980 [g/mol]
Molecular Formula
C35H52O4

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Specification

Synonyms
Bis(nonylphenyl) glutarate, EINECS 301-202-4, CID3023193, 93982-12-8
IUPAC Name
bis(2-nonylphenyl) pentanedioate
Canonical SMILES
CCCCCCCCCC1=CC=CC=C1OC(=O)CCCC(=O)OC2=CC=CC=C2CCCCCCCCC
InChI Key
XOLPFCCYOWNLPE-UHFFFAOYSA-N
Boiling Point
636.5ºC at 760mmHg
Flash Point
310.3ºC
Density
0.996g/cm³
EC Number
301-202-4
Exact Mass
536.38700
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of Bis-(nonylphenyl)glutarate?

The molecular formula of Bis-(nonylphenyl)glutarate is C35H52O4.

When was the structure of Bis-(nonylphenyl)glutarate created and modified?

The structure was created on August 8, 2005, and modified on December 30, 2023.

What is the IUPAC name of Bis-(nonylphenyl)glutarate?

The IUPAC name of Bis-(nonylphenyl)glutarate is bis(2-nonylphenyl) pentanedioate.

What is the InChIKey of Bis-(nonylphenyl)glutarate?

The InChIKey of Bis-(nonylphenyl)glutarate is XOLPFCCYOWNLPE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Bis-(nonylphenyl)glutarate have?

Bis-(nonylphenyl)glutarate has 0 hydrogen bond donor counts.

What is the topological polar surface area of Bis-(nonylphenyl)glutarate?

The topological polar surface area of Bis-(nonylphenyl)glutarate is 52.6 Ų.

How many rotatable bond counts does Bis-(nonylphenyl)glutarate have?

Bis-(nonylphenyl)glutarate has 24 rotatable bond counts.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized according to PubChem.

What is the molecular weight of Bis-(nonylphenyl)glutarate?

The molecular weight of Bis-(nonylphenyl)glutarate is 536.8 g/mol.

What is the exact mass of Bis-(nonylphenyl)glutarate?

The exact mass of Bis-(nonylphenyl)glutarate is 536.38656014 g/mol.

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