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21560-29-2

21560-29-2 | 1-Chloro-6,7-dimethoxyisoquinoline

CAS No: 21560-29-2 Catalog No: AG0038W1 MDL No:MFCD16249956

Product Description

Catalog Number:
AG0038W1
Chemical Name:
1-Chloro-6,7-dimethoxyisoquinoline
CAS Number:
21560-29-2
Molecular Formula:
C11H10ClNO2
Molecular Weight:
223.6556
MDL Number:
MFCD16249956
IUPAC Name:
1-chloro-6,7-dimethoxyisoquinoline
InChI:
InChI=1S/C11H10ClNO2/c1-14-9-5-7-3-4-13-11(12)8(7)6-10(9)15-2/h3-6H,1-2H3
InChI Key:
MPMDYPSDYGHVBM-UHFFFAOYSA-N
SMILES:
COc1cc2c(Cl)nccc2cc1OC

Properties

Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.04g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.656g/mol
Monoisotopic Mass:
223.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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