CAS
39800-16-3 Purity
---
39800-16-3 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C11H8ClNOS.
The molecular weight is 237.71 g/mol.
The IUPAC name is (2-aminothiophen-3-yl)-(2-chlorophenyl)methanone.
The InChI is InChI=1S/C11H8ClNOS/c12-9-4-2-1-3-7(9)10(14)8-5-6-15-11(8)13/h1-6H,13H2.
The InChIKey is PYKUZKXKWBHTCO-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C(=C1)C(=O)C2=C(SC=C2)N)Cl.
The CAS number is 40017-58-1.
It has 1 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.
It has 2 rotatable bond counts.