CAS
917561-99-0 Purity
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917561-99-0 Purity
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Specification
The molecular formula is C10H8Cl2N2.
It was created on 2007-11-13 and modified on 2023-12-30.
The IUPAC name is 7,8-dichloro-2-methylquinolin-4-amine.
The molecular weight is 227.09 g/mol.
The InChI is InChI=1S/C10H8Cl2N2/c1-5-4-8(13)6-2-3-7(11)9(12)10(6)14-5/h2-4H,1H3,(H2,13,14).
The Canonical SMILES is CC1=CC(=C2C=CC(=C(C2=N1)Cl)Cl)N.
It has 1 hydrogen bond donor count.
The XLogP3-AA value is 3.2.
It has 0 rotatable bond counts.
Yes, it is considered to be a canonicalized compound.