Cyclooctane-1,2,4-triol

Name: Cyclooctane-1,2,4-triol
SKU: ACM94249168
Rating: 5 (1 reviews)

CAS

94249-16-8

Catalog Number

ACM94249168

Category

Other Products

Molecular Weight

160.210840 [g/mol]

Molecular Formula

C₈H₁₆O₃

COA MSDS SDS Spec Sheet

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Specification

Synonyms

Cyclooctane-1,2,4-triol, EINECS 304-390-6, CID3024172, 94249-16-8

IUPAC Name

cyclooctane-1,2,4-triol

SMILES

C1CCC(C(CC(C1)O)O)O

InChI Key

YVBCGAYPLVHGSK-UHFFFAOYSA-N

Boiling Point

293.9ºC at 760mmHg

Flash Point

142.5ºC

Density

1.205g/cm³

EC Number

304-390-6

Exact Mass

160.11000

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of Cyclooctane-1,2,4-triol?

The molecular formula of Cyclooctane-1,2,4-triol is C8H16O3.

When was Cyclooctane-1,2,4-triol created and modified in PubChem?

Cyclooctane-1,2,4-triol was created on August 8, 2005, and last modified on December 30, 2023.

What is the IUPAC name of Cyclooctane-1,2,4-triol?

The IUPAC name of Cyclooctane-1,2,4-triol is cyclooctane-1,2,4-triol.

What is the InChIKey of Cyclooctane-1,2,4-triol?

The InChIKey of Cyclooctane-1,2,4-triol is YVBCGAYPLVHGSK-UHFFFAOYSA-N.

What is the Canonical SMILES of Cyclooctane-1,2,4-triol?

The Canonical SMILES of Cyclooctane-1,2,4-triol is C1CCC(C(CC(C1)O)O)O.

What is the molecular weight of Cyclooctane-1,2,4-triol?

The molecular weight of Cyclooctane-1,2,4-triol is 160.21 g/mol.

How many hydrogen bond donor counts does Cyclooctane-1,2,4-triol have?

Cyclooctane-1,2,4-triol has 3 hydrogen bond donor counts.

Does Cyclooctane-1,2,4-triol have any rotatable bond counts?

No, Cyclooctane-1,2,4-triol does not have any rotatable bond counts.

What is the topological polar surface area of Cyclooctane-1,2,4-triol?

The topological polar surface area of Cyclooctane-1,2,4-triol is 60.7 Å².

Is the compound of Cyclooctane-1,2,4-triol canonicalized in PubChem?

Yes, the compound of Cyclooctane-1,2,4-triol is canonicalized in PubChem.

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