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1426904-69-9 | 7-hydroxy-6-iodo-1,2,3,4-tetrahydroquinolin-2-one
CAS No: 1426904-69-9 Catalog No: AG00IXHL MDL No:MFCD23697505
Product Description
Catalog Number:
AG00IXHL
Chemical Name:
7-hydroxy-6-iodo-1,2,3,4-tetrahydroquinolin-2-one
CAS Number:
1426904-69-9
Molecular Formula:
C9H8INO2
Molecular Weight:
289.0698
MDL Number:
MFCD23697505
IUPAC Name:
7-hydroxy-6-iodo-3,4-dihydro-1H-quinolin-2-one
InChI:
InChI=1S/C9H8INO2/c10-6-3-5-1-2-9(13)11-7(5)4-8(6)12/h3-4,12H,1-2H2,(H,11,13)
InChI Key:
STMRQRQRIDHQOK-UHFFFAOYSA-N
SMILES:
O=C1CCc2c(N1)cc(c(c2)I)O
Properties
Complexity:
222
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.96g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
289.072g/mol
Monoisotopic Mass:
288.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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