Name: 2-methyl-5-nitro-1H-indole
SMILES:
Cc1cc2cc([N+](=O)[O-])ccc2[nH]1Molecular Processing
Molecular formula
C9H8N2O2
Molecular weight
176.18
Exact mass
176.0586
XLogP
2.38
TPSA
58.93
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
49.69
Supplementary Information
Details werden geladen…
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