6-Nitro-1-methyl-3-acetylindole
Basic information
- Standard SMILES
CC(=O)c1cn(C)c2cc([N+](=O)[O-])ccc12- InChIKey
DJCNZIVWZCTHIP-UHFFFAOYSA-N- Molecular formula
- C11H10N2O3
- Average molar mass
- 218.21 g/mol
- Monoisotopic mass
- 218.06914219
Names & identifiers
- Preferred name
- 6-Nitro-1-methyl-3-acetylindole
- IUPAC
- 1-(1-methyl-6-nitroindol-3-yl)ethanone
Names & synonyms
6-Nitro-1-methyl-3-acetylindoleDJCNZIVWZCTHIP-UHFFFAOYSA-NDTXSID6013548803-ACETYL-1-METHYL-6-NITROINDOLE1-(1-Methyl-6-nitro-1H-indol-3-yl)ethanone1-(1-Methyl-6-nitro-1H-indol-3-yl)ethanone #Q63392636
Database identifiers
- PubChem CID
- 608995
- DTXSID
DTXSID601354880- Nikkaji
- J45.173H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 67.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 313
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Related reactions
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Compound notes
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