Pss-(2-(trans-3 4-cyclohexanediol)ethyl&

CAS

480439-48-3

Catalog Number

ACM480439483

Category

Nanoparticles & Nanopowders

Molecular Weight

975.685

Molecular Formula

C₃₆H₇₈O₁₅Si₈

MSDS COA Spec Sheet

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Specification

Synonyms

PSS-(2-(TRANS-3 4-CYCLOHEXANEDIOL)ETHYL&;1-(2-TRANS-CYCLOHEXANEDIOL)ETHYL-3,5,7,9, 15-ISOBUTYLPENTACYCLO-OCTASILOXANE;1-(2-trans-cyclohexanediol)ethyl-3,5,7,9,11,13,15-isobutylpentacyclo-[9.5.1.13,9 .15,15.17,13]octasiloxane;pss-(2-(trans-3,4-cyclohexaned

IUPAC Name

AC1MUI3F

Melting Point

121-127ºC(lit.)

Exact Mass

974.34900

What is the molecular formula of the compound with PubChem CID 3641239?

The molecular formula is C36H78O14Si8.

When was this compound first created?

It was first created on September 9, 2005.

What is the molecular weight of the compound?

The molecular weight is 959.7 g/mol.

How many hydrogen bond donor counts does the compound have?

The compound has 2 hydrogen bond donor counts.

What is the hydrogen bond acceptor count of the compound?

The compound has 14 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass is 958.35456943 g/mol.

What is the topological polar surface area of the compound?

The topological polar surface area is 151Å².

How many heavy atoms are present in the compound?

There are 58 heavy atoms in the compound.

Does the compound have any defined atom stereocenter count?

No, the compound does not have any defined atom stereocenter count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

When was the compound created in PubChem?

It was created on September 9, 2005.

What is the IUPAC Name of the compound?

The IUPAC Name is 4-[2-[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 ]icosan-1-yl]ethyl]cyclohexane-1,2-diol.

What is the InChIKey of the compound?

The InChIKey is SPLVLZDHFGEUJL-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does the compound have?

The compound has 14 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 17 rotatable bond counts.

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