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6-Chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid ethyl ester

CAS
14714-18-2
Catalog Number
ACM14714182
Category
Imidazoles
Molecular Weight
239.66
Molecular Formula
C10H10ClN3O2

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Specification

Appearance
Solid
What is the molecular formula of the compound?

The molecular formula of the compound is C10H10ClN3O2.

What is the molecular weight of the compound?

The molecular weight of the compound is 239.66 g/mol.

What is the IUPAC name of the compound?

The IUPAC name of the compound is ethyl 6-chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylate.

What is the InChIKey of the compound?

The InChIKey of the compound is OJHHQMWNFHWAFR-UHFFFAOYSA-N.

What is the Canonical SMILES representation of the compound?

The Canonical SMILES representation of the compound is CCOC(=O)C1=C(N=C2N1N=C(C=C2)Cl)C.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 2.2.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does the compound have?

The compound has 4 hydrogen bond acceptor counts.

How many rotatable bond counts does the compound have?

The compound has 3 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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