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1282029-86-0 | 7-Quinolinol, 1,2,3,4-tetrahydro-1-[(4-methylphenyl)sulfonyl]-
CAS No: 1282029-86-0 Catalog No: AG000XUU MDL No:
Product Description
Catalog Number:
AG000XUU
Chemical Name:
7-Quinolinol, 1,2,3,4-tetrahydro-1-[(4-methylphenyl)sulfonyl]-
CAS Number:
1282029-86-0
Molecular Formula:
C16H17NO3S
Molecular Weight:
303.3761
IUPAC Name:
1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-quinolin-7-ol
InChI:
InChI=1S/C16H17NO3S/c1-12-4-8-15(9-5-12)21(19,20)17-10-2-3-13-6-7-14(18)11-16(13)17/h4-9,11,18H,2-3,10H2,1H3
InChI Key:
OOZIMCHFINASKU-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N1CCCc2c1cc(O)cc2
Properties
Complexity:
451
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.093g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.376g/mol
Monoisotopic Mass:
303.093g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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