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Home > Indoles and Oxindole > 873055-09-5
873055-09-5 | 2-(tert-Butyl)-6-nitro-1H-indole
CAS No: 873055-09-5 Catalog No: AG00IEH0 MDL No:
Product Description
Catalog Number:
AG00IEH0
Chemical Name:
2-(tert-Butyl)-6-nitro-1H-indole
CAS Number:
873055-09-5
IUPAC Name:
2-tert-butyl-6-nitro-1H-indole
InChI:
InChI=1S/C12H14N2O2/c1-12(2,3)11-6-8-4-5-9(14(15)16)7-10(8)13-11/h4-7,13H,1-3H3
InChI Key:
COQNCAZGNLRPHM-UHFFFAOYSA-N
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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