Basic information
- CAS
58258-68-7- Standard SMILES
O=[N+]([O-])c1ccc2cc(I)ccc2c1- InChIKey
HOSUDLAAQNPVAC-UHFFFAOYSA-N- Molecular formula
- C10H6INO2
- Average molar mass
- 299.06 g/mol
- Monoisotopic mass
- 298.94433
Names & identifiers
- Preferred name
- 2-Iodo-6-nitronaphthalene
- IUPAC
- 2-iodo-6-nitronaphthalene
- English name
- 2-Iodo-6-nitronaphthalene
- Molecular formula
- C10H6INO2
- Molecular weight
- 299.06
Names & synonyms
2-iodo-6-nitronaphthalene58258-68-7SCHEMBL28257123DTXSID00395140AKOS024342519DB-083746Naphthalene, 2-iodo-6-nitro-
Database identifiers
- CAS
58258-68-7- PubChem CID
- 3693910
- DTXSID
DTXSID00395140- EC Number
- 150-923-9
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 229
Physicochemical properties
- Melting point
- 231 °C · 231 °C
- Boiling point
- 397.2 · 397.2±15.0 °C(Predicted)
- Density
- 1.899 · 1.899±0.06 g/cm3(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SYNCHEM-OHG[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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