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1447-40-1 | 4-Quinolinol, 5,8-dichloro-2-methyl-
CAS No: 1447-40-1 Catalog No: AG001K17 MDL No:
Product Description
Catalog Number:
AG001K17
Chemical Name:
4-Quinolinol, 5,8-dichloro-2-methyl-
CAS Number:
1447-40-1
Molecular Formula:
C10H7Cl2NO
Molecular Weight:
228.0747
IUPAC Name:
5,8-dichloro-2-methyl-1H-quinolin-4-one
InChI:
InChI=1S/C10H7Cl2NO/c1-5-4-8(14)9-6(11)2-3-7(12)10(9)13-5/h2-4H,1H3,(H,13,14)
InChI Key:
XVRYYBYRGBLMKT-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c2c(n1)c(Cl)ccc2Cl
NSC Number:
137128
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.99g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.072g/mol
Monoisotopic Mass:
226.99g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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