2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

• Catalog Number: ACM1022919863
• Product Name: 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
• CAS: 1022919-86-3
• Category: Heterocyclic Organic Compound
• Synonyms: 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid;2-ethyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid(SALTDATA: HCl);3-Isoquinolinecarboxylic acid, 2-ethyl-1,2,3,4-tetrahydro-;3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-2-ethyl-
• Molecular Weight: 205.253
• Molecular Formula: C₁₂H₁₅NO₂
• Density: 1.158±0.06 g/cm³ (20 ºC 760 Torr)

Custom Q&A

What is the molecular formula of 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid?

The molecular formula is C12H15NO2.

When was the compound 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid created in PubChem?

It was created on August 9, 2005.

What is the IUPAC name of 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid?

The IUPAC name is 2-ethyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid.

What is the InChI Key of the compound?

The InChI Key is TXYDLJGQBRAFBU-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the topological polar surface area value of 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid?

The topological polar surface area is 40.5 Å2.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the molecular weight of 2-Ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid?

The molecular weight is 205.25 g/mol.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is -0.5.

How many rotatable bond counts does the compound have?

The compound has 2 rotatable bond counts.