Structure

1,3-Dichloro-7-fluoroisoquinoline

CAS
941294-25-3
Catalog Number
ACM941294253
Category
Other Products
Molecular Weight
216.0
Molecular Formula
C9H4Cl2FN

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What is the molecular formula of 1,3-Dichloro-7-fluoroisoquinoline?

The molecular formula is C9H4Cl2FN.

When was 1,3-Dichloro-7-fluoroisoquinoline first created in PubChem?

It was first created on May 28, 2009.

What is the IUPAC name of 1,3-Dichloro-7-fluoroisoquinoline?

The IUPAC name is 1,3-dichloro-7-fluoroisoquinoline.

What is the InChI Key of 1,3-Dichloro-7-fluoroisoquinoline?

The InChI Key is RPCBWABYLPCEQX-UHFFFAOYSA-N.

What is the Canonical SMILES representation of 1,3-Dichloro-7-fluoroisoquinoline?

The Canonical SMILES representation is C1=CC(=CC2=C(N=C(C=C21)Cl)Cl)F.

What is the CAS number for 1,3-Dichloro-7-fluoroisoquinoline?

The CAS number is 941294-25-3.

What is the molecular weight of 1,3-Dichloro-7-fluoroisoquinoline?

The molecular weight is 216.04 g/mol.

How many hydrogen bond donor counts does 1,3-Dichloro-7-fluoroisoquinoline have?

It has 0 hydrogen bond donor counts.

What is the topological polar surface area of 1,3-Dichloro-7-fluoroisoquinoline?

The topological polar surface area is 12.9 Ų.

Is the compound canonicalized in PubChem?

Yes, the compound is canonicalized in PubChem.

Downstream Synthesis Route 1

  • 540-88-5
  • 941294-25-3
  • 1312784-46-5

Reference: [1]Patent: US2011/152243,2011,A1 .Location in patent: Page/Page column 100

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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