|
Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
4
Total Number of Articles : 5
|
| PubChem |
11890
|
| Molecular Formula |
C8H7NO4 |
| SMILES |
CC(=O)OC1=CC=CC=C1[N+](=O)[O-] |
| InChI |
InChI=1S/C8H7NO4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3 |
| synonyms |
- 2-NITROPHENYL ACETATE
- 610-69-5
- o-Nitrophenyl acetate
- Acetic acid, 2-nitrophenyl ester
- 2-Nitrophenol acetate
- Acetic acid, o-nitrophenyl ester
- AI3-21066
- NSC 5397
- EINECS 210-233-1
- DTXSID7060590
- DTXCID2042937
- 210-233-1
- (2-nitrophenyl) acetate
- Nitrophenyl Acetate
- o-NPA
- M2F7VE48GB
- NSC-5397
- 2-NITROPHENYLACETATE
- MFCD00007095
- ACETIC ACID 2-NITROPHENYL ESTER
- UNII-M2F7VE48GB
- 2-ACETOXYNITROBENZENE
- SCHEMBL471777
- CHEMBL460363
- BDBM22723
- NSC5397
- AKOS003418848
- BS-52010
- DB-053785
- CS-0199181
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|
| Properties |
| Property |
Value |
| MW |
181.15 g/mol |
| HBD |
0 |
| HBA |
4 |
| Rotatable Bond Count |
2 |
| Exact Mass |
181.03750770 g/mol |
| Monoisotopic Mass |
181.03750770 g/mol |
| Heavy Atom Count |
13 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
211 |
| xlogp |
1.6 |
| Topological Polar Surface Area |
72.1 |
|