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4-(4-Fluorophenyl)-2-methyl-5-oxazolecarboxylic acid methyl ester

CAS
914287-71-1
Catalog Number
ACM914287711
Category
Other Products
Molecular Formula
C12H10FNO3

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What is the molecular formula of the compound in PubChem CID 53415158?

The molecular formula is C12H10FNO3.

What is the molecular weight of the compound?

The molecular weight is 235.21 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is methyl 4-(4-fluorophenyl)-2-methyl-1,3-oxazole-5-carboxylate.

What is the InChI code for the compound?

The InChI code is InChI=1S/C12H10FNO3/c1-7-14-10(11(17-7)12(15)16-2)8-3-5-9(13)6-4-8/h3-6H,1-2H3.

What is the InChIKey for the compound?

The InChIKey is NCGCHFJZHHCASH-UHFFFAOYSA-N.

What is the canonical SMILES representation of the compound?

The canonical SMILES representation is CC1=NC(=C(O1)C(=O)OC)C2=CC=C(C=C2)F.

What is the CAS number for the compound?

The CAS number is 914287-71-1.

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 5 hydrogen bond acceptor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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