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1231761-14-0 | Quinoline, 4-chloro-5-methoxy-
CAS No: 1231761-14-0 Catalog No: AG000K4E MDL No:
Product Description
Catalog Number:
AG000K4E
Chemical Name:
Quinoline, 4-chloro-5-methoxy-
CAS Number:
1231761-14-0
Molecular Formula:
C10H8ClNO
Molecular Weight:
193.6296
IUPAC Name:
4-chloro-5-methoxyquinoline
InChI:
InChI=1S/C10H8ClNO/c1-13-9-4-2-3-8-10(9)7(11)5-6-12-8/h2-6H,1H3
InChI Key:
MHSPKKXMNJNWHR-UHFFFAOYSA-N
SMILES:
COc1cccc2c1c(Cl)ccn2
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.029g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.63g/mol
Monoisotopic Mass:
193.029g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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