CAS
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Specification
The molecular formula is C8H11NO.
The molecular weight is 137.18 g/mol.
The IUPAC name is 4-(methoxymethyl)aniline.
The InChI code is InChI=1S/C8H11NO/c1-10-6-7-2-4-8(9)5-3-7/h2-5H,6,9H2,1H3.
The InChIKey is URSADVDNUKPSIK-UHFFFAOYSA-N.
The canonical SMILES is COCC1=CC=C(C=C1)N.
The CAS number is 80936-82-9.
The XLogP3 value is 0.3.
It has 1 hydrogen bond donor count.
It has 2 hydrogen bond acceptor counts.