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Home > Indoles and Oxindole > 885266-72-8
885266-72-8 | 4-(4-Nitro-1H-indol-3-yl)butan-2-one
CAS No: 885266-72-8 Catalog No: AG01DP8M MDL No:MFCD04973981
Product Description
Catalog Number:
AG01DP8M
Chemical Name:
4-(4-Nitro-1H-indol-3-yl)butan-2-one
CAS Number:
885266-72-8
MDL Number:
MFCD04973981
IUPAC Name:
4-(4-nitro-1H-indol-3-yl)butan-2-one
InChI:
InChI=1S/C12H12N2O3/c1-8(15)5-6-9-7-13-10-3-2-4-11(12(9)10)14(16)17/h2-4,7,13H,5-6H2,1H3
InChI Key:
DODINSMBTAQWQA-UHFFFAOYSA-N
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.239g/mol
Monoisotopic Mass:
232.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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