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Structure

1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene

CAS
221243-98-7
Catalog Number
ACM221243987
Category
Heterocyclic Organic Compound; Ethers
Molecular Weight
402.48
Molecular Formula
C20H34O8

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Specification

Synonyms
1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene, 1,4-Bis(triethoxymethoxy)benzene, 221243-98-7, 1,4-Bis(2-(2-(2-methoxyethoxy)ethoxy)ethoxy)benzene, ACMC-20ap39, SureCN3611926, 644277_ALDRICH, CTK8C6210, AKOS015889126, I01-16999
IUPAC Name
1,4-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzene
Canonical SMILES
COCCOCCOCCOC1=CC=C(C=C1)OCCOCCOCCOC
InChI Key
GLFDQJMQVPBQCE-UHFFFAOYSA-N
Boiling Point
480ºC at 760 mmHg
Flash Point
>230 °F
Density
1.1082 g/mL at 25ºC(lit.)
Exact Mass
402.22500
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
8
H-Bond Donor
0
RIDADR
NONH for all modes of transport
Safety Description
26
Symbol
GHS07
What is the molecular formula of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The molecular formula is C20H34O8.

What is the molecular weight of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The molecular weight is 402.5 g/mol.

What is the IUPAC name of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The IUPAC name is 1,4-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]benzene.

What is the InChI of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The InChI is InChI=1S/C20H34O8/c1-21-7-9-23-11-13-25-15-17-27-19-3-5-20(6-4-19)28-18-16-26-14-12-24-10-8-22-2/h3-6H,7-18H2,1-2H3.

What is the InChIKey of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The InChIKey is GLFDQJMQVPBQCE-UHFFFAOYSA-N.

What is the canonical SMILES of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The canonical SMILES is COCCOCCOCCOC1=CC=C(C=C1)OCCOCCOCCOC.

What is the CAS number of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The CAS number is 221243-98-7.

What is the EC number of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The EC number is 623-650-2.

What is the DSSTox Substance ID of 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene?

The DSSTox Substance ID is DTXSID50584567.

Is 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene a canonicalized compound?

Yes, 1,4-Bis(1,4,7,10-tetraoxaundecyl)benzene is a canonicalized compound.

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