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Home > Indoles and Oxindole > 1491230-49-9
1491230-49-9 | 1-[(4-methylbenzene)sulfonyl]-2-nitro-1H-indole
CAS No: 1491230-49-9 Catalog No: AG00HXOR MDL No:
Product Description
Catalog Number:
AG00HXOR
Chemical Name:
1-[(4-methylbenzene)sulfonyl]-2-nitro-1H-indole
CAS Number:
1491230-49-9
IUPAC Name:
1-(4-methylphenyl)sulfonyl-2-nitroindole
InChI:
InChI=1S/C15H12N2O4S/c1-11-6-8-13(9-7-11)22(20,21)16-14-5-3-2-4-12(14)10-15(16)17(18)19/h2-10H,1H3
InChI Key:
UQSBORGGAUVMSE-UHFFFAOYSA-N
Properties
Complexity:
517
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.052g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
316.331g/mol
Monoisotopic Mass:
316.052g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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