CAS
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Specification
The molecular formula is C9H13NO2.
The molecular weight is 167.20 g/mol.
The IUPAC name is 3-(2-methoxyethoxy)aniline.
The InChI of the compound is InChI=1S/C9H13NO2/c1-11-5-6-12-9-4-2-3-8(10)7-9/h2-4,7H,5-6,10H2,1H3.
The InChIKey is RNNUSMIPHMAFKN-UHFFFAOYSA-N.
The canonical SMILES is COCCOC1=CC=CC(=C1)N.
The CAS number is 110178-35-3.
The European Community (EC) number is 852-808-5.
The monoisotopic mass is 167.094628657 g/mol.
Yes, the compound is canonicalized.