9-Acetoxy-2-nitrofluorene
Basic information
- CAS
107915-53-7- Standard SMILES
CC(=O)OC1c2ccccc2-c2ccc([N+](=O)[O-])cc21- InChIKey
VHOLNJWMRGLXCC-UHFFFAOYSA-N- Molecular formula
- C15H11NO4
- Average molar mass
- 269.25 g/mol
- Monoisotopic mass
- 269.06880783
Names & identifiers
- Preferred name
- 9-Acetoxy-2-nitrofluorene
- IUPAC
- (2-nitro-9H-fluoren-9-yl) acetate
- English name
- 9-Acetoxy-2-nitrofluorene
- Molecular formula
- C15H11NO4
- Molecular weight
- 269.25
Names & synonyms
9-ACETOXY-2-NITROFLUORENE107915-53-7RefChem:549154669-098-62-nitro-9H-fluoren-9-yl acetateNSC123992-nitro-9H-fluoren-9-ylacetateNSC-12399AKOS0243378309H-Fluoren-9-ol, 2-nitro-, 9-acetate
Database identifiers
- CAS
107915-53-7- PubChem CID
- 224129
- EC Number
- 669-098-6
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 405
Physicochemical properties
- Melting point
- 155.5 · 155.5-156.0 °C(Solv: acetone (67-64-1))
- Boiling point
- 415.5 · 415.5±45.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400-H302
- Precautionary statements
- 273 · P273-P391-P501-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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, 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
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H400-H302
- Precautionary statements
- P273-P391-P501-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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