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Structure

1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene

CAS
211809-84-6
Catalog Number
ACM211809846-1
Category
Amino Alcohols
Molecular Weight
610.44

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Specification

Hazard Statements
H302-H314
RIDADR
NONH for all modes of transport
Symbol
GHS05
What is the molecular formula of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The molecular formula is C26H44I2.

What is the molecular weight of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The molecular weight is 610.4 g/mol.

What is the IUPAC name of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The IUPAC name is 1,4-bis(3,7-dimethyloctyl)-2,5-diiodobenzene.

What is the InChI of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The InChI is InChI=1S/C26H44I2/c1-19(2)9-7-11-21(5)13-15-23-17-26(28)24(18-25(23)27)16-14-22(6)12-8-10-20(3)4/h17-22H,7-16H2,1-6H3.

What is the InChIKey of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The InChIKey is LJNUMLPEKWLXIO-UHFFFAOYSA-N.

What is the canonical SMILES of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The canonical SMILES is CC(C)CCCC(C)CCC1=CC(=C(C=C1I)CCC(C)CCCC(C)C)I.

What is the CAS number of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The CAS number is 211809-84-6.

What is the European Community (EC) Number of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The European Community (EC) Number is 621-532-5.

What is the XLogP3-AA value of 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene?

The XLogP3-AA value is 12.3.

Is 1,4-Bis(3,7-dimethyloctyl)-2,5-diiodobenzene a canonicalized compound?

Yes, it is a canonicalized compound.

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