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Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene

CAS
94021-60-0
Catalog Number
ACM94021600
Category
Other Products
Molecular Weight
178.27072;g/mol
Molecular Formula
C12H18O

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Specification

Canonical SMILES
CC12CC3C4CCC(C4)C3C1(O2)C
InChI Key
PALRMMBVTSAXSM-UHFFFAOYSA-N
EC Number
301-455-0
What is the molecular formula of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The molecular formula is C12H18O.

What is the molecular weight of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The molecular weight is 178.27 g/mol.

When was Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene created in PubChem?

It was created on August 20, 2009.

What is the IUPAC name of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The IUPAC name is 3,5-dimethyl-4-oxatetracyclo[6.2.1.0 2,7 .0 3,5 ]undecane.

What is the InChIKey of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The InChIKey is PALRMMBVTSAXSM-UHFFFAOYSA-N.

What is the Canonical SMILES of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The Canonical SMILES is CC12CC3C4CCC(C4)C3C1(O2)C.

What is the CAS number of Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The CAS number is 94021-60-0.

What is the XLogP3-AA value for Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene?

The XLogP3-AA value is 2.7.

How many hydrogen bond acceptors does Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene have?

It has one hydrogen bond acceptor.

Is Octahydrodimethyl-2,5-methano-2H-indeno[1,2-b]oxirene a canonicalized compound in PubChem?

Yes, it is a canonicalized compound in PubChem.

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