CAS
952479-14-0 Purity
96%
952479-14-0 Purity
96%
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5-Fluoro-3-methyl-2-nitrobenzoic acid methyl ester
CAS
952479-97-9
Catalog Number
ACM952479979
Category
Other Products
Molecular Formula
C9H8FNO4
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What is the molecular formula of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The molecular formula is C9H8FNO4.
What are the synonyms of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The synonyms are METHYL 5-FLUORO-3-METHYL-2-NITROBENZOATE, 952479-97-9, 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester, methyl 5-fluoro-3-methyl-2-nitro-benzoate, and SCHEMBL1056662.
What is the molecular weight of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The molecular weight is 213.16 g/mol.
What is the IUPAC Name of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The IUPAC Name is methyl 5-fluoro-3-methyl-2-nitrobenzoate.
What is the InChI of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The InChI is InChI=1S/C9H8FNO4/c1-5-3-6(10)4-7(9(12)15-2)8(5)11(13)14/h3-4H,1-2H3.
What is the InChIKey of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The InChIKey is VFTXULHKYAMECP-UHFFFAOYSA-N.
What is the Canonical SMILES of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The Canonical SMILES is CC1=CC(=CC(=C1[N+](=O)[O-])C(=O)OC)F.
What is the XLogP3-AA value of 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester?
The XLogP3-AA value is 2.1.
How many hydrogen bond acceptors does 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester have?
It has 5 hydrogen bond acceptors.
Is 5-fluoro-3-methyl-2-nitrobenzoic acid methyl ester a canonicalized compound?
Yes, it is a canonicalized compound.
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