Isoquinoline, 1-chloro-6,7-dimethoxy-


Chemical Name: Isoquinoline, 1-chloro-6,7-dimethoxy-
CAS Number: 21560-29-2
Product Number: AG0038W1(AGN-PC-0N815G)
Synonyms:
MDL No:
Molecular Formula: C11H10ClNO2
Molecular Weight: 223.6556

Identification/Properties


Computed Properties
Molecular Weight:
223.656g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
223.04g/mol
Monoisotopic Mass:
223.04g/mol
Topological Polar Surface Area:
31.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
215
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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