CAS
1417407-29-4 Purity
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1417407-29-4 Purity
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Methyl 5-fluoro-6-methoxynicotinate
CAS
953780-40-0
Catalog Number
ACM953780400
Category
Pyridines
Molecular Weight
185.2
Molecular Formula
C8H8FNO3
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What is the molecular formula of Methyl 5-fluoro-6-methoxynicotinate?
The molecular formula is C8H8FNO3.
What is the molecular weight of Methyl 5-fluoro-6-methoxynicotinate?
The molecular weight is 185.15 g/mol.
What is the IUPAC name of Methyl 5-fluoro-6-methoxynicotinate?
The IUPAC name is methyl 5-fluoro-6-methoxypyridine-3-carboxylate.
What is the InChI of Methyl 5-fluoro-6-methoxynicotinate?
The InChI is InChI=1S/C8H8FNO3/c1-12-7-6(9)3-5(4-10-7)8(11)13-2/h3-4H,1-2H3.
What is the InChIKey of Methyl 5-fluoro-6-methoxynicotinate?
The InChIKey is HJBPCUZDKHCJRR-UHFFFAOYSA-N.
What is the canonical SMILES of Methyl 5-fluoro-6-methoxynicotinate?
The canonical SMILES is COC1=C(C=C(C=N1)C(=O)OC)F.
What is the XLogP3-AA value of Methyl 5-fluoro-6-methoxynicotinate?
The XLogP3-AA value is 1.1.
How many hydrogen bond donor counts does Methyl 5-fluoro-6-methoxynicotinate have?
Methyl 5-fluoro-6-methoxynicotinate has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does Methyl 5-fluoro-6-methoxynicotinate have?
Methyl 5-fluoro-6-methoxynicotinate has 5 hydrogen bond acceptor counts.
What is the topological polar surface area of Methyl 5-fluoro-6-methoxynicotinate?
The topological polar surface area is 48.4 Å2.
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