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Structure

1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile

CAS
166398-34-1
Catalog Number
ACM166398341
Category
Other Products
Molecular Weight
158.1998
Molecular Formula
C10H10N2

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Specification

Synonyms
1,2,3,4-TETRAHYDROISOQUINOLINE-6-CARBONITRILE;6-TRIFLUORO-1,2,3,4-TETRAHYDROISOQUINOLINE;C90106;6-Isoquinolinecarbonitrile, 1,2,3,4-tetrahydro-;1,2,3,4-tetrahydro-6-isoquinolinecarbonitrile;1,2,3,4-TETRAHYDROISOQUINOLINE-6-CARBONITRILE-13;1,2,3,4-Tetrahydro-isoquinolin-6-carbonitrile
What is the molecular formula of 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile?

The molecular formula is C10H10N2.

When was the compound created and last modified?

It was created on October 25, 2006, and last modified on December 30, 2023.

What is the IUPAC name of 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile?

The IUPAC name is 1,2,3,4-tetrahydroisoquinoline-6-carbonitrile.

What is the InChIKey of the compound?

The InChIKey is RKWNQODBLXZUES-UHFFFAOYSA-N.

How many hydrogen bond donor counts does the compound have?

The compound has 1 hydrogen bond donor count.

What is the exact mass of 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile?

The exact mass is 158.084398327 g/mol.

How many hydrogen bond acceptor counts does the compound have?

The compound has 2 hydrogen bond acceptor counts.

What is the topological polar surface area of the compound?

The topological polar surface area is 35.8 Ų.

How many rotatable bond counts does the compound have?

The compound has 0 rotatable bond counts.

Is 1,2,3,4-Tetrahydroisoquinoline-6-carbonitrile a canonicalized compound?

Yes, the compound is canonicalized.

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