CAS
1986-47-6 Purity
---
1986-47-6 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C8H12ClNO2S.
The molecular weight is 221.71 g/mol.
The IUPAC name is (2-methylsulfonylphenyl)methanamine;hydrochloride.
The InChI is InChI=1S/C8H11NO2S.ClH/c1-12(10,11)8-5-3-2-4-7(8)6-9;/h2-5H,6,9H2,1H3;1H.
The InChIKey is ITWDFVUNCISBDX-UHFFFAOYSA-N.
The canonical SMILES is CS(=O)(=O)C1=CC=CC=C1CN.Cl.
The CAS number is 342816-14-2.
It has 2 hydrogen bond donor counts.
It has 3 hydrogen bond acceptor counts.
It has 2 rotatable bond counts.