Basic information
- CAS
35973-24-1- Standard SMILES
O=C(O)c1c[nH]c2ccc([N+](=O)[O-])cc2c1=O- InChIKey
HVEINHUJRQCZNZ-UHFFFAOYSA-N- Molecular formula
- C10H6N2O5
- Average molar mass
- 234.16 g/mol
- Monoisotopic mass
- 234.0276713
Names & identifiers
- Preferred name
- 3-Quinolinecarboxylic acid, 4-hydroxy-6-nitro-
- IUPAC
- 6-nitro-4-oxo-1H-quinoline-3-carboxylic acid
- English name
- 6-Nitro-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid
- Molecular formula
- C10H6N2O5
- Molecular weight
- 234.16
Names & synonyms
35973-24-14-Hydroxy-6-nitro-3-quinolinecarboxylic acid3-Quinolinecarboxylic acid, 4-hydroxy-6-nitro-NSC-77094NSC-79184GXW2A9E7U9DTXSID40189520RefChem:1068781DTXCID001120114-Hydroxy-6-nitroquinoline-3-carboxylic acid6-nitro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid52980-22-0
Show more names
-Nitro-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid3-Quinolinecarboxylic acid, 1,4-dihydro-6-nitro-4-oxo-
6-nitro-4-oxo-1H-quinoline-3-carboxylic acid4-Hydroxy-6-nitro-3-carboxyquinoline6-nitro-4-oxo-1,4-dihydro-quinoline-3-carboxylic acidMLS002694012WLN: T66 BNJ DVQ EQ HNWMFCD009686773-Quinolinecarboxylicacid, 4-hydroxy-6-nitro-NSC 77094
Database identifiers
- CAS
35973-24-1、52980-22-0- PubChem CID
- 96508
- DTXSID
DTXSID40189520- ChEMBL
CHEMBL1716997- UNII
- GXW2A9E7U9
- Nikkaji
- J48.211K
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 411
Chemistry & industry
Suppliers6 total
苏州亚衍医药科技有限公司17715136450 · [email protected]
苏州施亚生物科技有限公司86(512)5235 8471 17715136450 · [email protected]
衢州爱美康生物科技有限公司0570-3081766 18357083060 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
湖北省善乐兴生物科技有限公司18321145570 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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