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Home > Indoles and Oxindole > 90536-91-7
90536-91-7 | 1-PIPERIDIN-4-YL-1,3-DIHYDRO-2H-INDOL-2-ONE
CAS No: 90536-91-7 Catalog No: AG00GVMA MDL No:MFCD04037979
Product Description
Catalog Number:
AG00GVMA
Chemical Name:
1-PIPERIDIN-4-YL-1,3-DIHYDRO-2H-INDOL-2-ONE
CAS Number:
90536-91-7
MDL Number:
MFCD04037979
IUPAC Name:
3,5-bis(methylsulfonyl)benzoic acid
InChI:
InChI=1S/C9H10O6S2/c1-16(12,13)7-3-6(9(10)11)4-8(5-7)17(2,14)15/h3-5H,1-2H3,(H,10,11)
InChI Key:
QFEITAHBBXTWDV-UHFFFAOYSA-N
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.992g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.293g/mol
Monoisotopic Mass:
277.992g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
122A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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