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Home > Indoles and Oxindole > 21005-49-2
21005-49-2 | 5-(2-Nitropropenyl)Indole
CAS No: 21005-49-2 Catalog No: AG01E3QS MDL No:
Product Description
Catalog Number:
AG01E3QS
Chemical Name:
5-(2-Nitropropenyl)Indole
CAS Number:
21005-49-2
IUPAC Name:
5-[(E)-2-nitroprop-1-enyl]-1H-indole
InChI:
InChI=1S/C11H10N2O2/c1-8(13(14)15)6-9-2-3-11-10(7-9)4-5-12-11/h2-7,12H,1H3/b8-6+
InChI Key:
CDJAXOVRQMNDKE-SOFGYWHQSA-N
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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