Structure

Benzothiazole,2-(2-methyl-3-furyl)-(7ci)

CAS
91493-30-0
Catalog Number
ACM91493300
Category
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What is the molecular formula of Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

The molecular formula is C12H9NOS.

When was Benzothiazole,2-(2-methyl-3-furyl)-(7ci) created on PubChem?

It was created on September 6, 2005.

What is the Canonical SMILES of Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

The Canonical SMILES is CC1=C(C=CO1)C2=NC3=CC=CC=C3S2.

How many hydrogen bond acceptors does Benzothiazole,2-(2-methyl-3-furyl)-(7ci) have?

It has 3 hydrogen bond acceptors.

What is the XLogP3 value of Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

The XLogP3 value is 3.7.

What is the exact mass of Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

The exact mass is 215.04048508 g/mol.

How many rotatable bond counts does Benzothiazole,2-(2-methyl-3-furyl)-(7ci) have?

It has 1 rotatable bond count.

What is the topological polar surface area of Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

The topological polar surface area is 54.3 Ų.

Does Benzothiazole,2-(2-methyl-3-furyl)-(7ci) contain any isotope atom?

No, it does not contain any isotope atom.

Is the compound canonicalized in PubChem for Benzothiazole,2-(2-methyl-3-furyl)-(7ci)?

Yes, the compound is canonicalized in PubChem.

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