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Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
10
Total Number of Articles : 11
|
| PubChem |
15352
|
| Molecular Formula |
C16H11N |
| SMILES |
C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)N |
| InChI |
InChI=1S/C16H11N/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H,17H2 |
| synonyms |
- 1-Aminopyrene
- 1606-67-3
- 1-PYRENAMINE
- 3-Aminopyrene
- Pyren-1-ylamine
- Pyrene, amino-
- alpha-Aminopyrene
- CCRIS 760
- 1-Aminopyren
- EINECS 216-521-3
- NSC 11436
- BRN 1875737
- LUW9EO1681
- AMINOPYRENE, 1-
- NSC-11436
- .ALPHA.-AMINOPYRENE
- DTXSID3040932
- 4-12-00-03464 (Beilstein Handbook Reference)
- alphaAminopyrene
- 1Pyrenamine
- 3Aminopyrene
- Pyrene, amino
- DTXCID1020932
- 216-521-3
- pyren-1-amine
- Pyrenamine
- Aminopyrene
- N-1-AMINOPYRENE
- 1-Pyrenamin
- MFCD00004140
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| Properties |
| Property |
Value |
| MW |
217.26 g/mol |
| HBD |
1 |
| HBA |
1 |
| Rotatable Bond Count |
0 |
| Exact Mass |
217.089149355 g/mol |
| Monoisotopic Mass |
217.089149355 g/mol |
| Heavy Atom Count |
17 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
300 |
| xlogp |
4.3 |
| Topological Polar Surface Area |
26 |
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