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15365-53-4 | Isoquinolin-4-ol hydrochloride
CAS No: 15365-53-4 Catalog No: AG007XYN MDL No:MFCD23140980
Product Description
Catalog Number:
AG007XYN
Chemical Name:
Isoquinolin-4-ol hydrochloride
CAS Number:
15365-53-4
Molecular Formula:
C9H8ClNO
Molecular Weight:
181.6189
MDL Number:
MFCD23140980
IUPAC Name:
isoquinolin-4-ol;hydrochloride
InChI:
InChI=1S/C9H7NO.ClH/c11-9-6-10-5-7-3-1-2-4-8(7)9;/h1-6,11H;1H
InChI Key:
NZNGQIWJAYMQKL-UHFFFAOYSA-N
SMILES:
Oc1cncc2c1cccc2.Cl
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.619g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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