3-(2-Methoxy-phenyl)-propylamine

• Catalog Number: ACMA00001994
• Category: Ethers
• Molecular Weight: 165.23
• Molecular Formula: C₁₀H₁₅NO
• Hazard Statements: H318
• RIDADR: NONH for all modes of transport
• Symbol: GHS05

Custom Q&A

What is the molecular formula of the compound?

The molecular formula is C10H15NO.

What is the molecular weight of the compound?

The molecular weight is 165.23 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 3-(2-methoxyphenyl)propan-1-amine.

What is the InChI of the compound?

The InChI is InChI=1S/C10H15NO/c1-12-10-7-3-2-5-9(10)6-4-8-11/h2-3,5,7H,4,6,8,11H2,1H3.

What is the InChIKey of the compound?

The InChIKey is BRVUZJVOHZQUSX-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is COC1=CC=CC=C1CCCN.

What is the CAS number of the compound?

The CAS number is 18655-51-1.

What is the XLogP3 value of the compound?

The XLogP3 value is 2.1.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

How many rotatable bond counts does the compound have?

The compound has 4 rotatable bond counts.