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55086-55-0

55086-55-0 | Isoquinoline, 3,7-dimethoxy- (9CI)

CAS No: 55086-55-0 Catalog No: AG00DHDC MDL No:

Product Description

Catalog Number:
AG00DHDC
Chemical Name:
Isoquinoline, 3,7-dimethoxy- (9CI)
CAS Number:
55086-55-0
IUPAC Name:
3,7-dimethoxyisoquinoline
InChI:
InChI=1S/C11H11NO2/c1-13-10-4-3-8-6-11(14-2)12-7-9(8)5-10/h3-7H,1-2H3
InChI Key:
JAZCDQHTFHNPIX-UHFFFAOYSA-N

Properties

Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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