CAS
88112-75-8 Purity
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88112-75-8 Purity
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Specification
The molecular formula is C8H10FN.
The molecular weight is 139.17 g/mol.
The IUPAC name is 1-(3-fluorophenyl)-N-methylmethanamine.
The InChI is InChI=1S/C8H10FN/c1-10-6-7-3-2-4-8(9)5-7/h2-5,10H,6H2,1H3.
The InChIKey is ZXWCKKSSCIFVBT-UHFFFAOYSA-N.
The canonical SMILES is CNCC1=CC(=CC=C1)F.
The CAS number is 90389-84-7.
The EC number is 627-017-1.
The XLogP3 value is 1.7.
Yes, 3-Fluoro-N-methylbenzylamine is a canonicalized compound.