3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-6-methoxy-


Chemical Name: 3-Quinolinecarbonitrile, 4-chloro-7-hydroxy-6-methoxy-
CAS Number: 263149-10-6
Product Number: AG002SOH(AGN-PC-0O8EI0)
Synonyms:
MDL No:
Molecular Formula: C11H7ClN2O2
Molecular Weight: 234.6385

Identification/Properties


Computed Properties
Molecular Weight:
234.639g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
234.02g/mol
Monoisotopic Mass:
234.02g/mol
Topological Polar Surface Area:
66.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
304
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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