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Structure

1-[1-(Phenoxymethyl)cyclopropyl]methanamine

CAS
959240-02-9
Catalog Number
ACM959240029
Category
Ethers
Molecular Weight
177.24
Molecular Formula
C11H14O4

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Specification

Hazard Statements
H301-H319
RIDADR
NONH for all modes of transport
Symbol
GHS06
What is the molecular formula of the compound with the PubChem CID 28064583?

The molecular formula is C11H15NO.

When was the compound created in PubChem?

The compound was created on May 28, 2009.

What is the IUPAC name of the compound?

The IUPAC name is [1-(phenoxymethyl)cyclopropyl]methanamine.

What is the InChI of the compound?

The InChI is InChI=1S/C11H15NO/c12-8-11(6-7-11)9-13-10-4-2-1-3-5-10/h1-5H,6-9,12H2.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.6.

What is the topological polar surface area of the compound?

The topological polar surface area is 35.2 Ų.

Does the compound have any defined atom stereocenters?

No, the compound does not have any defined atom stereocenters.

How many rotatable bond counts does the compound have?

The compound has 4 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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