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884500-89-4 | Phenol, 4-(3-isoquinolinyl)-, hydrochloride (1
CAS No: 884500-89-4 Catalog No: AG00GUPX MDL No:
Product Description
Catalog Number:
AG00GUPX
Chemical Name:
Phenol, 4-(3-isoquinolinyl)-, hydrochloride (1
CAS Number:
884500-89-4
IUPAC Name:
4-isoquinolin-3-ylphenol;hydrochloride
InChI:
InChI=1S/C15H11NO.ClH/c17-14-7-5-11(6-8-14)15-9-12-3-1-2-4-13(12)10-16-15;/h1-10,17H;1H
InChI Key:
JELWYMVSWDPGNO-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.717g/mol
Monoisotopic Mass:
257.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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