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521313-72-4

521313-72-4 | 5-Isoquinolinol,6-propyl-(9CI)

CAS No: 521313-72-4 Catalog No: AG00DZ90 MDL No:

Product Description

Catalog Number:
AG00DZ90
Chemical Name:
5-Isoquinolinol,6-propyl-(9CI)
CAS Number:
521313-72-4
IUPAC Name:
6-propylisoquinolin-5-ol
InChI:
InChI=1S/C12H13NO/c1-2-3-9-4-5-10-8-13-7-6-11(10)12(9)14/h4-8,14H,2-3H2,1H3
InChI Key:
UDERHUMTYVYELM-UHFFFAOYSA-N

Properties

Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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