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184375-93-7 | 3,3-dimethyl-2-oxido-4H-isoquinolin-4-ol
CAS No: 184375-93-7 Catalog No: AG00B06R MDL No:
Product Description
Catalog Number:
AG00B06R
Chemical Name:
3,3-dimethyl-2-oxido-4H-isoquinolin-4-ol
CAS Number:
184375-93-7
IUPAC Name:
3,3-dimethyl-2-oxido-4H-isoquinolin-2-ium-4-ol
InChI:
InChI=1S/C11H13NO2/c1-11(2)10(13)9-6-4-3-5-8(9)7-12(11)14/h3-7,10,13H,1-2H3
InChI Key:
KDBJLPJKUYFPPC-UHFFFAOYSA-N
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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