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Structure

Chembrdg-bb 9071653

CAS
915921-02-7
Catalog Number
ACM915921027
Category
Other Products
Molecular Formula
C12H19NO

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Specification

Synonyms
CHEMBRDG-BB 9071653;N-METHYL-2-(2,3,6-TRIMETHYLPHENOXY)ETHANAMINE
What is the molecular formula of the compound with Chembrdg-bb 9071653?

The molecular formula is C12H19NO.

When was this compound created according to PubChem?

It was created on May 28, 2009.

What is the Canonical SMILES of the compound?

The Canonical SMILES is CC1=C(C(=C(C=C1)C)OCCNC)C.

How many hydrogen bond donor counts does this compound have?

It has 1 hydrogen bond donor count.

What is the XLogP3-AA value of this compound?

The XLogP3-AA value is 2.6.

What is the heavy atom count of the compound?

The heavy atom count is 14.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized.

What is the exact mass of this compound?

The exact mass is 193.146664230 g/mol.

How many rotatable bond counts does this compound have?

It has 4 rotatable bond counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 21.3?2.

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