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308110-07-8 | 1(2H)-Isoquinolinone, 3,4-dihydro-6-hydroxy-2-methyl-
CAS No: 308110-07-8 Catalog No: AG0031DS MDL No:MFCD13179449
Product Description
Catalog Number:
AG0031DS
Chemical Name:
1(2H)-Isoquinolinone, 3,4-dihydro-6-hydroxy-2-methyl-
CAS Number:
308110-07-8
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
MDL Number:
MFCD13179449
IUPAC Name:
6-hydroxy-2-methyl-3,4-dihydroisoquinolin-1-one
InChI:
InChI=1S/C10H11NO2/c1-11-5-4-7-6-8(12)2-3-9(7)10(11)13/h2-3,6,12H,4-5H2,1H3
InChI Key:
FDHLLTYAKGOFLY-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)CCN(C2=O)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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