Basic information
- CAS
5408-55-9- Standard SMILES
O=[N+]([O-])c1ccc2c(c1)oc1ccc([N+](=O)[O-])cc12- InChIKey
VVSJARSODDEAAL-UHFFFAOYSA-N- Molecular formula
- C12H6N2O5
- Average molar mass
- 258.19 g/mol
- Monoisotopic mass
- 258.0276713
Names & identifiers
- Preferred name
- 2,7-Dinitrodibenzofuran
- IUPAC
- 2,7-dinitrodibenzofuran
- English name
- 2,7-DINITRODIBENZOFURAN
- Molecular formula
- C12H6N2O5
- Molecular weight
- 258.18644
Names & synonyms
2,7-DinitrodibenzofuranDibenzofuran, 2,7-dinitro-3,8-Dinitrodibenzofuran5408-55-9CCRIS 5088BRN 0277401DTXSID502024114-17-00-00594 (Beilstein Handbook Reference)NSC 10860RefChem:248828DTXCID50124902659-672-4
Show more names
NSC108602,7-dini-trodibenzofuran2,7-Dinitrodibenzo[b,d]furanNSC-10860AKOS003658769NS00126153
Database identifiers
- CAS
5408-55-9- PubChem CID
- 94963
- DTXSID
DTXSID50202411- EC Number
- 659-672-4
- Nikkaji
- J501.125F
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 391
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H302-H318-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H302-H318-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310-P264-P270-P301+P312-P330-P501
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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