Structure

(2-Ethylhexyl)hydrogen octylphosphonate

CAS
93920-07-1
Catalog Number
ACM93920071
Category
Other Products
Molecular Weight
306.421061
Molecular Formula
C16H35O3P

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Specification

Synonyms
(2-ethylhexyl) hydrogen octylphosphonate;Octylphosphonic acid hydrogen 2-ethylhexyl ester
What is the molecular formula of (2-Ethylhexyl)hydrogen octylphosphonate?

The molecular formula is C16H35O3P.

What is the molecular weight of (2-Ethylhexyl)hydrogen octylphosphonate?

The molecular weight is 306.42 g/mol.

What is the IUPAC name of (2-Ethylhexyl)hydrogen octylphosphonate?

The IUPAC name is 2-ethylhexoxy(octyl)phosphinic acid.

What is the InChIKey of (2-Ethylhexyl)hydrogen octylphosphonate?

The InChIKey is KYYFFXSFMAVEDS-UHFFFAOYSA-N.

What is the Canonical SMILES of (2-Ethylhexyl)hydrogen octylphosphonate?

The Canonical SMILES is CCCCCCCCP(=O)(O)OCC(CC)CCCC.

How many hydrogen bond donor counts does (2-Ethylhexyl)hydrogen octylphosphonate have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does (2-Ethylhexyl)hydrogen octylphosphonate have?

It has 3 hydrogen bond acceptor counts.

What is the topological polar surface area of (2-Ethylhexyl)hydrogen octylphosphonate?

The topological polar surface area is 46.5 Å2.

How many rotatable bond counts does (2-Ethylhexyl)hydrogen octylphosphonate have?

It has 14 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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