Basic information
- CAS
27254-36-0- Standard SMILES
O=[N+]([O-])c1cccc2ccccc12- InChIKey
RJKGJBPXVHTNJL-UHFFFAOYSA-N- Molecular formula
- C10H7NO2
- Average molar mass
- 173.17 g/mol
- Monoisotopic mass
- 173.04767847
Names & identifiers
- Preferred name
- 1-Nitronaphthalene
- IUPAC
- 1-nitronaphthalene
- English name
- Nitronaphthalene
- Molecular formula
- C10H7NO2
- Molecular weight
- 173.17
Names & synonyms
1-NITRONAPHTHALENE86-57-7Naphthalene, 1-nitro-alpha-NitronaphthaleneNitrol (pesticide)NCI-C01956DTXSID7020978A51NP1DL2TCHEBI:34104NSC-9584DTXCID70978RefChem:907736
Show more names
Nitronapthalene
201-684-5NitrolNaphthalene, nitro-MononitronaphthaleneNITRONAPHTHALENE1-Nitronaftalen.alpha.-Nitronaphthalene27254-36-0
Database identifiers
- CAS
27254-36-0、86-57-7- PubChem CID
- 6849
- DTXSID
DTXSID7020978- ChEMBL
CHEMBL165373- ChEBI
CHEBI:34104- UNII
- A51NP1DL2T
- EC Number
- 201-684-5
- Nikkaji
- J3.536J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 200
Physicochemical properties
- Melting point
- 61.5 °C · 61.5°C
- Boiling point
- 303.81 °C · 303.81°C (rough estimate)
- Density
- 1.332 · 1.3320
- refractive index
- 1.52 · 1.5200 (estimate)
- CAS DataBase Reference
- 27254 · 27254-36-0
- EPA Substance Registry System
- Naphthalene, nitro- (27254-36-0)
Chemistry & industry
Applications
General DescriptionA yellow crystalline solid. Insoluble in water and denser than water. May irritate skin and eyes. Readily ignitable and may be difficult to extinguish once ignited. Used to make dyes and other chemicals.
Suppliers16 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
广东大小化工有限公司1866-171603 18666171603 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
上海钰康生物科技有限公司15618758386 15618758386 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
武汉弘德悦欣医药科技有限公司027-83850116 18164090116 · [email protected]
武汉弘德悦欣医药科技有限公司02783850058 15377551550 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
上海宝杨宝欣生物科技有限公司021-56698539 19921169802 · [email protected]
武汉欣扬瑞和化学科技有限公司027-18120580375 18120580375 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
山东彬睿特新材料有限公司0533-2866658 15615638350 · [email protected]
武汉弘德悦欣医药科技有限公司027-83855391 13657260109 · [email protected]
Additional notes
DefinitionChEBI: 1-nitronaphthalene is a mononitronaphthalene substituted by a nitro group at position 1. It has a role as an environmental contaminant and a mouse metabolite.
Related reactions
19 records
Compound notes
Loading…