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Home > Indoles and Oxindole > 144024-39-5
144024-39-5 | Ethanol, 2-[[1-(phenylsulfonyl)-1H-indol-4-yl]oxy]-
CAS No: 144024-39-5 Catalog No: AG001IT1 MDL No:
Product Description
Catalog Number:
AG001IT1
Chemical Name:
Ethanol, 2-[[1-(phenylsulfonyl)-1H-indol-4-yl]oxy]-
CAS Number:
144024-39-5
Molecular Formula:
C16H15NO4S
Molecular Weight:
317.3596
IUPAC Name:
2-[1-(benzenesulfonyl)indol-4-yl]oxyethanol
InChI:
InChI=1S/C16H15NO4S/c18-11-12-21-16-8-4-7-15-14(16)9-10-17(15)22(19,20)13-5-2-1-3-6-13/h1-10,18H,11-12H2
InChI Key:
FQBVLPYKMPNOKE-UHFFFAOYSA-N
SMILES:
OCCOc1cccc2c1ccn2S(=O)(=O)c1ccccc1
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.072g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.359g/mol
Monoisotopic Mass:
317.072g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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