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850655-62-8 | 4-nitro-1-(phenylsulfonyl)-1H-indole
CAS No: 850655-62-8 Catalog No: AG00G7MW MDL No:
Product Description
Catalog Number:
AG00G7MW
Chemical Name:
4-nitro-1-(phenylsulfonyl)-1H-indole
CAS Number:
850655-62-8
IUPAC Name:
1-(benzenesulfonyl)-4-nitroindole
InChI:
InChI=1S/C14H10N2O4S/c17-16(18)14-8-4-7-13-12(14)9-10-15(13)21(19,20)11-5-2-1-3-6-11/h1-10H
InChI Key:
IXFDFHBVHBVZBR-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:
3.1
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