Basic information
- CAS
2801-29-8- Standard SMILES
Cc1ccnc2c([N+](=O)[O-])cccc12- InChIKey
ZNGIJEBXIREQLE-UHFFFAOYSA-N- Molecular formula
- C10H8N2O2
- Average molar mass
- 188.18 g/mol
- Monoisotopic mass
- 188.0585775
Names & identifiers
- Preferred name
- 4-Methyl-8-nitroquinoline
- IUPAC
- 4-methyl-8-nitroquinoline
- English name
- 4-Methyl-8-nitroquinoline
- Molecular formula
- C10H8N2O2
- Molecular weight
- 188.18
Names & synonyms
4-Methyl-8-nitroquinoline4-Methyl-8-nitro-QuinolineQuinoline, 4-methyl-8-nitro-NSC 120755DTXSID9062649RefChem:99817DTXCID7037761ZNGIJEBXIREQLE-UHFFFAOYSA-N2801-29-8Lepidine, 8-nitro-8-nitro-4-methylquinolineMFCD00234625
Show more names
AKOS BBS-000030824-Methyl-8-nitroquinoline in isooctane5-Nitro-4-Methylquinoline 8-Nitro-4-Methylquinoline
NSC120755Cambridge id 5215252Oprea1_645221SCHEMBL4642926CHEMBL2358273SBB001642STK098790AKOS000271598
Database identifiers
- CAS
2801-29-8- PubChem CID
- 76048
- DTXSID
DTXSID9062649- ChEMBL
CHEMBL2358273- Nikkaji
- J421.638E
Properties
Computed structural properties
- XLogP
- 2.6
- 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
- 125 · 125-126 °C
- Boiling point
- 340.8 · 340.8±27.0 °C(Predicted)
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 1.87 · 1.87±0.30(Predicted)
- Appearance
- White to off-white Solid
- EPA Substance Registry System
- 4 · 4-Methyl-8-nitroquinoline (2801-29-8)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationQuinoline, 4-methyl-8-nitro-: INACTIVE
Upstream & downstream products
Downstream products
Suppliers30 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
西安瑞成医药科技有限责任公司18220540598; 18291828687 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
吉林中科研伸科技有限公司0431-80514535 19917294565 · [email protected]
苏州启航生物科技有限公司18151111370
Related reactions
4 records
Compound notes
Loading…