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1105194-02-2 | 5-HYDROXY-2-PROPYLISOQUINOLIN-1(2H)-ONE
CAS No: 1105194-02-2 Catalog No: AG01ARPA MDL No:MFCD11986501
Product Description
Catalog Number:
AG01ARPA
Chemical Name:
5-HYDROXY-2-PROPYLISOQUINOLIN-1(2H)-ONE
CAS Number:
1105194-02-2
MDL Number:
MFCD11986501
IUPAC Name:
5-hydroxy-2-propylisoquinolin-1-one
InChI:
InChI=1S/C12H13NO2/c1-2-7-13-8-6-9-10(12(13)15)4-3-5-11(9)14/h3-6,8,14H,2,7H2,1H3
InChI Key:
NAZDTCOZWQNPGX-UHFFFAOYSA-N
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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