CAS
912770-05-9 Purity
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912770-05-9 Purity
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6-m-Tolyl-imidazo[2,1-b]thiazole-3-carboxylic acid
CAS
912770-19-5
Catalog Number
ACM912770195
Category
Other Products
Molecular Weight
258.2957
Molecular Formula
C13H10N2O2S
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Specification
Synonyms
6-M-TOLYL-IMIDAZO[2,1-B]THIAZOLE-3-CARBOXYLIC ACID;6-(3-METHYLPHENYL)IMIDAZO[2,1-B]THIAZOLE-3-CARBOXYLIC ACID
What is the molecular formula of the compound?
The molecular formula of the compound is C13H10N2O2S.
What is the molecular weight of the compound?
The molecular weight of the compound is 258.30 g/mol.
What is the CAS number (alternative identifier) of the compound?
The CAS number of the compound is 912770-19-5.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 6-(3-methylphenyl)imidazo[2,1-b][1,3]thiazole-3-carboxylic acid.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES representation of the compound is CC1=CC(=CC=C1)C2=CN3C(=CSC3=N2)C(=O)O.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C13H10N2O2S/c1-8-3-2-4-9(5-8)10-6-15-11(12(16)17)7-18-13(15)14-10/h2-7H,1H3,(H,16,17).
What is the InChIKey of the compound?
The InChIKey of the compound is DUMIMFQWJWGVCA-UHFFFAOYSA-N.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 3.7.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 82.8 ?2.
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