CAS
947533-56-4 Purity
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947533-56-4 Purity
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4-(7-Bromo-imidazo[1,2-a]pyridin-2-yl)-benzoic acid methyl ester
CAS
947533-62-2
Catalog Number
ACM947533622
Category
Other Products
Molecular Weight
331.16404
Molecular Formula
C15H11BrN2O2
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Specification
Synonyms
4-(7-Bromo-imidazo[1,2-a]pyridin-2-yl)-benzoic acid methyl ester
What is the molecular formula of the compound?
The molecular formula of the compound is C15H11BrN2O2.
What is the IUPAC name of the compound?
The IUPAC name of the compound is methyl 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)benzoate.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C15H11BrN2O2/c1-20-15(19)11-4-2-10(3-5-11)13-9-18-7-6-12(16)8-14(18)17-13/h2-9H,1H3.
What is the InChIKey of the compound?
The InChIKey of the compound is LNBBLQIJXDAHML-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is COC(=O)C1=CC=C(C=C1)C2=CN3C=CC(=CC3=N2)Br.
What is the molecular weight of the compound?
The molecular weight of the compound is 331.16 g/mol.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 4.
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 3 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
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