6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile

• Catalog Number: ACMA00002351
• Category: Ethers
• Molecular Weight: 232.28
• Molecular Formula: C₁₃H₁₄O₃
• Hazard Statements: H302-H317-H318
• RIDADR: NONH for all modes of transport
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The molecular formula is C13H16N2O2.

When was 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile created?

It was created on July 19, 2005.

What is the IUPAC name of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The IUPAC name is 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)acetonitrile.

What is the InChI of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The InChI is InChI=1S/C13H16N2O2/c1-16-12-7-9-4-6-15-11(3-5-14)10(9)8-13(12)17-2/h7-8,11,15H,3-4,6H2,1-2H3.

What is the InChIKey of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The InChIKey is UVGYAOQHGGLHHV-UHFFFAOYSA-N.

What is the Canonical SMILES of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The Canonical SMILES is COC1=C(C=C2C(NCCC2=C1)CC#N)OC.

What is the molecular weight of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The molecular weight is 232.28 g/mol.

What is the XLogP3-AA value of 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile?

The XLogP3-AA value is 1.

How many hydrogen bond donor counts does 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile have?

It has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 6,7-Dimethoxy-1,2,3,4-tetrahydro-1-isoquinoline acetonitrile have?

It has 4 hydrogen bond acceptor counts.