CAS
1074-91-5 Purity
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1074-91-5 Purity
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Specification
The molecular formula is C6H5F2NO.
The molecular weight is 145.11 g/mol.
The IUPAC name is 5-amino-2,4-difluorophenol.
The InChI code is InChI=1S/C6H5F2NO/c7-3-1-4(8)6(10)2-5(3)9/h1-2,10H,9H2.
The InChIKey is CXADAFQCFSVRGN-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C(=CC(=C1O)F)F)N.
The CAS number is 113512-71-3.
The EC number is 802-531-0.
The XLogP3-AA value is 1.1.
Yes, 5-Amino-2,4-difluorophenol is a canonicalized compound.