CAS
94191-15-8 Purity
96%
94191-15-8 Purity
96%
![N-Cyclohexyl-N-methyl-4-[(2-oxo-5,10-dihydro-3H-imidazo[2,1-b]quinazolin-7-yl)oxy]butanamide](https://resource.alfa-chemistry.com/structure/94192-59-3.gif)
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3-[3-(2-Methylphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
CAS
94192-15-1
Catalog Number
ACM94192151
Category
Other Products
Molecular Weight
232.24
Molecular Formula
C12H12N2O3
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Specification
Synonyms
3-[3-(2-METHYLPHENYL)-1,2,4-OXADIAZOL-5-YL]PROPANOIC ACID;AKOS BB-7065;CHEMBRDG-BB 9071164;AKOS BBV-016932;OTAVA-BB 1149441;UKRORGSYN-BB BBV-016932
What is the molecular formula of the compound in the reference?
The molecular formula is C12H12N2O3.
What is the molecular weight of the compound?
The molecular weight is 232.23 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 3-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CC1=CC=CC=C1C2=NOC(=N2)CCC(=O)O.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 76.2?2.
How many rotatable bond counts does the compound have?
The compound has 4 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the exact mass of the compound?
The exact mass is 232.08479225 g/mol.
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CAS
94192-18-4 Purity
96%
94192-18-4 Purity
96%
