|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
732
Total Number of Articles : 1014
|
| PubChem |
798
|
| Molecular Formula |
C8H7N |
| SMILES |
C1=CC=C2C(=C1)C=CN2 |
| InChI |
InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H |
| synonyms |
- indole
- 1H-Indole
- 120-72-9
- 2,3-Benzopyrrole
- Indol
- 1-Benzazole
- Ketole
- 1-Azaindene
- Benzopyrrole
- 2,3-Benzopyrole
- Indole (natural)
- Caswell No. 498B
- 1-Benzo(b)pyrrole
- Indol [German]
- FEMA No. 2593
- CCRIS 4421
- HSDB 599
- EPA Pesticide Chemical Code 025000
- 1H-Benzo[b]pyrrole
- Benzo[b]pyrrole
- AI3-01540
- NSC 1964
- EINECS 204-420-7
- MFCD00005607
- UNII-8724FJW4M5
- INDOLUM
- DTXSID0020737
- CHEBI:16881
- 8724FJW4M5
- NSC-1964
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| Properties |
| Property |
Value |
| MW |
117.15 g/mol |
| HBD |
1 |
| HBA |
0 |
| Rotatable Bond Count |
0 |
| Exact Mass |
117.057849228 g/mol |
| Monoisotopic Mass |
117.057849228 g/mol |
| Heavy Atom Count |
9 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
101 |
| xlogp |
2.1 |
| Topological Polar Surface Area |
15.8 |
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