953411-10-4 Purity
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Specification
The molecular formula of 5-Fluoro-2-methylbenzaldehyde oxime is C8H8FNO.
The molecular weight of 5-Fluoro-2-methylbenzaldehyde oxime is 153.15 g/mol.
The IUPAC name of 5-Fluoro-2-methylbenzaldehyde oxime is (NE)-N-[(5-fluoro-2-methylphenyl)methylidene]hydroxylamine.
The InChI of 5-Fluoro-2-methylbenzaldehyde oxime is InChI=1S/C8H8FNO/c1-6-2-3-8(9)4-7(6)5-10-11/h2-5,11H,1H3/b10-5+.
The InChIKey of 5-Fluoro-2-methylbenzaldehyde oxime is LLFXCAZWWMXKQU-BJMVGYQFSA-N.
The canonical SMILES of 5-Fluoro-2-methylbenzaldehyde oxime is CC1=C(C=C(C=C1)F)C=NO.
The isomeric SMILES of 5-Fluoro-2-methylbenzaldehyde oxime is CC1=C(C=C(C=C1)F)/C=N/O.
5-Fluoro-2-methylbenzaldehyde oxime has 1 hydrogen bond donor count.
5-Fluoro-2-methylbenzaldehyde oxime has 3 hydrogen bond acceptor counts.
5-Fluoro-2-methylbenzaldehyde oxime has 1 rotatable bond count.