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Structure

2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol

CAS
93892-33-2
Catalog Number
ACM93892332
Category
Other Products
Molecular Weight
302.451000 [g/mol]
Molecular Formula
C20H30O2

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Specification

Synonyms
EINECS 299-515-3, 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol, 93892-33-2
IUPAC Name
2,6-dicyclopentyl-4-(methoxymethyl)-3,5-dimethylphenol
Canonical SMILES
CC1=C(C(=C(C(=C1C2CCCC2)O)C3CCCC3)C)COC
InChI Key
PJBVNWALMGORST-UHFFFAOYSA-N
EC Number
299-515-3
Exact Mass
302.22500
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol?

The molecular formula of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is C20H30O2.

When was 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol created and modified?

2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol was created on 2009-08-20 and modified on 2023-12-30.

What is the IUPAC name of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol?

The IUPAC name of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is 2,6-dicyclopentyl-4-(methoxymethyl)-3,5-dimethylphenol.

What is the InChIKey of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol?

The InChIKey of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is PJBVNWALMGORST-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol have?

2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol has 1 hydrogen bond donor count.

What is the topological polar surface area of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol?

The topological polar surface area of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is 29.5 Ų.

Is 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol considered canonicalized?

Yes, 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is considered canonicalized.

How many rotatable bond counts does 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol have?

2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol has 4 rotatable bond counts.

What is the XLogP3-AA value of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol?

The XLogP3-AA value of 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol is 5.9.

How many defined atom stereocenter counts does 2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol have?

2,6-Dicyclopentyl-4-(methoxymethyl)-3,5-xylenol has 0 defined atom stereocenter counts.

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