Basic information
- CAS
23877-94-3- Standard SMILES
Cc1ccc2c([N+](=O)[O-])cccc2n1- InChIKey
XJHADKRGUJCHOO-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2
- Average molar mass
- 188.18 g/mol
- Monoisotopic mass
- 188.0585775
Names & identifiers
- Preferred name
- 2-Methyl-5-nitroquinoline
- IUPAC
- 2-methyl-5-nitroquinoline
- English name
- AKOS 92897
- Molecular formula
- C10H8N2O2
- Molecular weight
- 188.18
Names & synonyms
2-methyl-5-nitroquinoline23877-94-3AKOS 928972-methyl-5-nitro-quinolineNSC1639745-nitro-2methylquinoline5-nitro-2-methylquinolineMLS000374913SCHEMBL3955324CHEMBL1588648DTXSID20304032XJHADKRGUJCHOO-UHFFFAOYSA-N
Show more names
NSC 163974AKOS BC-1675AKOS A0602-04565-NitroquinaldineAKOS BBS-00001937OTAVA-BB 71185605565-nitro-2-metilchinolina
HMS2560I21YAA87794SBB039330STK040997AKOS000267802NSC-163974SB67746SMR000254267
Database identifiers
- CAS
23877-94-3- PubChem CID
- 294867
- DTXSID
DTXSID20304032- ChEMBL
CHEMBL1588648- EC Number
- 106-197-0
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Melting point
- 84 · 84-85℃ (methanol )
- Boiling point
- 323.8 · 323.8±27.0 °C(Predicted)
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.65 · 3.65±0.50(Predicted)
Chemistry & industry
Suppliers16 total
上海策嵘生物科技有限公司[email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
济南千叶医药技术有限公司0531-81313138 13066006660 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
重庆星灿医药科技有限公司13594048950 19923294409 · [email protected]
南京斯诺嘉医药科技有限公司188 5197 8348 18851978348
上海书亚医药科技有限公司400-685-9117 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
石家庄靖康科技有限公司13933818572 · [email protected]
南京阿斯法姆医药科技有限公司02558867862; 18751812725 · [email protected]
南京艾瑞博生物科技有限公司19951442182
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
Related reactions
8 records
Compound notes
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