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Home > Indoles and Oxindole > 193686-80-5
193686-80-5 | 1H-Indole, 2-nitro-1-(phenylsulfonyl)-
CAS No: 193686-80-5 Catalog No: AG00I310 MDL No:
Product Description
Catalog Number:
AG00I310
Chemical Name:
1H-Indole, 2-nitro-1-(phenylsulfonyl)-
CAS Number:
193686-80-5
IUPAC Name:
1-(benzenesulfonyl)-2-nitroindole
InChI:
InChI=1S/C14H10N2O4S/c17-16(18)14-10-11-6-4-5-9-13(11)15(14)21(19,20)12-7-2-1-3-8-12/h1-10H
InChI Key:
PTDYFWLGVSTLJN-UHFFFAOYSA-N
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.036g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.304g/mol
Monoisotopic Mass:
302.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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