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861565-91-5 | 6-hydroxy-1,2,3,4-tetrahydroquinolin-4-one
CAS No: 861565-91-5 Catalog No: AG01B2S7 MDL No:MFCD20669734
Product Description
Catalog Number:
AG01B2S7
Chemical Name:
6-hydroxy-1,2,3,4-tetrahydroquinolin-4-one
CAS Number:
861565-91-5
Molecular Formula:
C9H9NO2
Molecular Weight:
163.1733
MDL Number:
MFCD20669734
IUPAC Name:
6-hydroxy-2,3-dihydro-1H-quinolin-4-one
InChI:
InChI=1S/C9H9NO2/c11-6-1-2-8-7(5-6)9(12)3-4-10-8/h1-2,5,10-11H,3-4H2
InChI Key:
BEKIRMKVOPTZKU-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)C(=O)CCN2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.176g/mol
Monoisotopic Mass:
163.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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