Basic information
- CAS
19353-86-7- Standard SMILES
O=[N+]([O-])c1ccc2c(c1)CCCC2- InChIKey
OMJAUAQKUSAPIJ-UHFFFAOYSA-N- Molecular formula
- C10H11NO2
- Average molar mass
- 177.2 g/mol
- Monoisotopic mass
- 177.07897859
Names & identifiers
- Preferred name
- 6-Nitrotetralin
- IUPAC
- 6-nitro-1,2,3,4-tetrahydronaphthalene
- English name
- 1,2,3,4-tetrahydro-6-nitronaphthalene
- Molecular formula
- C10H11NO2
- Molecular weight
- 177.2
Names & synonyms
6-Nitrotetralin6-Nitro-1,2,3,4-tetrahydronaphthalene19353-86-71,2,3,4-Tetrahydro-6-nitronaphthalene6-nitro-tetralinEINECS 242-984-6NSC159114Naphthalene, 1,2,3,4-tetrahydro-6-nitro-SCHEMBL2083495SCHEMBL23174894DTXSID30172961MFCD05859559
Show more names
SBB013298STK779973AKOS005619125CCG-356227NSC 159114NSC-159114Naphthalene,2,3,4-tetrahydro-6-nitro-6-Nitro-1,2,3,4-tetrahydronaphthalene #
Database identifiers
- CAS
19353-86-7- PubChem CID
- 88018
- DTXSID
DTXSID30172961- EC Number
- 242-984-6
- Nikkaji
- J144.610J
Properties
Computed structural properties
- XLogP
- 3.1
- 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
- 31 °C · 31 °C
- Boiling point
- 294.5 · 294.5±29.0 °C(Predicted)
- Density
- 1.196 · 1.196±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
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上海黎枫医药科技有限公司021-13681628734 13681628734 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
4 records
Compound notes
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