Structure

Pss-chloropropyl-heptaisobutyl substitu&

CAS
480438-84-4
Catalog Number
ACM480438844
Category
Nanoparticles & Nanopowders
Molecular Weight
894.015
Molecular Formula
C31H69ClO12Si8

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Specification

Synonyms
PSS-CHLOROPROPYL-HEPTAISOBUTYL SUBSTITU&;1-CHLOROPROPYL-3,5,7,9,11,-ISOBUTYLPENTA-CYCLO-(9.5.1.1(3,9).)OCTASILOXANE, 97%;pss-chloropropyl-heptaisobutyl substituted;Chloropropylisobutyl-PSS,PSS-Chloropropyl-isobutylsubstituted,1-Chloropropyl-3,5,7,9,11,13,
IUPAC Name
Chloropropylisobutyl-PSS
Canonical SMILES
CC(C)C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CCCCl
InChI Key
XVYCGZTZIHTXDL-UHFFFAOYSA-N
Melting Point
214-219ºC(lit.)
Exact Mass
892.26300
What is the molecular formula of Pss-chloropropyl-heptaisobutyl substitu& according to the reference?

The molecular formula is C31H69ClO12Si8.

When was Pss-chloropropyl-heptaisobutyl substitu& created according to the reference?

It was created on September 13, 2005.

What is the computed IUPAC name of Pss-chloropropyl-heptaisobutyl substitu&?

The computed IUPAC name is 1-(3-chloropropyl)-3,5,7,9,11,13,15-heptakis(2-methylpropyl)-2,4,6,8,10,12,14,16,17,18,19,20-dodecaoxa-1,3,5,7,9,11,13,15-octasilapentacyclo[9.5.1.1 3,9 .1 5,15 .1 7,13 ]icosane.

What is the canonical SMILES of Pss-chloropropyl-heptaisobutyl substitu&?

The canonical SMILES is CC(C)C[Si]12O[Si]3(O[Si]4(O[Si](O1)(O[Si]5(O[Si](O2)(O[Si](O3)(O[Si](O4)(O5)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CC(C)C)CCC

What is the molecular weight of Pss-chloropropyl-heptaisobutyl substitu& according to PubChem?

The molecular weight is 894.0 g/mol.

How many hydrogen bond acceptors does Pss-chloropropyl-heptaisobutyl substitu& have?

It has 12 hydrogen bond acceptors.

What is the topological polar surface area of Pss-chloropropyl-heptaisobutyl according to the reference?

The topological polar surface area is 111Ų.

How many rotatable bond counts are there in Pss-chloropropyl-heptaisobutyl substitu&?

There are 17 rotatable bond counts.

What is the exact mass of Pss-chloropropyl-heptaisobutyl substitu&?

The exact mass is 892.2631676 g/mol.

What is the complexity of Pss-chloropropyl-heptaisobutyl according to the reference?

The complexity is 1080.

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