|
Structure
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|
| Relationships |
Total Number of functionally related protein(s) :
14
Total Number of Articles : 35
|
| PubChem |
4675622
|
| Molecular Formula |
C6H5NO4 |
| SMILES |
C1=CC(=C(C(=C1)O)O)[N+](=O)[O-] |
| InChI |
InChI=1S/C6H5NO4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,8-9H |
| synonyms |
- 3-nitrobenzene-1,2-diol
- 6665-98-1
- 3-Nitrocatechol
- 3-nitro-1,2-benzenediol
- MFCD00463758
- nitrocatechol
- 3-Nitro-benzene-1,2-diol
- NSC407241
- 2,3-dihydroxy-nitrobenzene
- SCHEMBL70167
- 1,2-Benzenediol, 3-nitro-
- CHEMBL288446
- SCHEMBL5468335
- SCHEMBL6208168
- SCHEMBL9336847
- DTXSID90901759
- YHKWFDPEASWKFQ-UHFFFAOYSA-N
- SBB087050
- STK065233
- AKOS005071755
- AE-0007
- CS-W006455
- NSC-407241
- FN150029
- DB-014316
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| Properties |
| Property |
Value |
| MW |
155.11 g/mol |
| HBD |
2 |
| HBA |
4 |
| Rotatable Bond Count |
0 |
| Exact Mass |
155.02185764 g/mol |
| Monoisotopic Mass |
155.02185764 g/mol |
| Heavy Atom Count |
11 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
155 |
| xlogp |
1.2 |
| Topological Polar Surface Area |
86.3 |
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