CAS
960198-48-5 Purity
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960198-48-5 Purity
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2-(3-Fluorophenyl)pyrimidine-5-carboxylic acid methyl ester
CAS
960198-51-0
Catalog Number
ACM960198510
Category
Other Products
Molecular Formula
C12H9FN2O2
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Specification
Synonyms
2-(3-Fluorophenyl)pyrimidine-5-carboxylic acid methyl ester
What is the molecular formula of the compound?
The molecular formula is C12H9FN2O2.
What is the molecular weight of the compound?
The molecular weight is 232.21 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is methyl 2-(3-fluorophenyl)pyrimidine-5-carboxylate.
What is the InChI of the compound?
The InChI is InChI=1S/C12H9FN2O2/c1-17-12(16)9-6-14-11(15-7-9)8-3-2-4-10(13)5-8/h2-7H,1H3.
What is the InChIKey of the compound?
The InChIKey is FXWRWVBHWUPQAV-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
It has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
It has 5 hydrogen bond acceptor counts.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 1.8.
What is the topological polar surface area of the compound?
The topological polar surface area is 52.1 Å2.
Is the compound Canonicalized?
Yes, the compound is Canonicalized.
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