Basic information
- CAS
3096-50-2- Standard SMILES
CC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1-2- InChIKey
PYGNVSDRIIPHQP-UHFFFAOYSA-N- Molecular formula
- C15H11NO2
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.07897859
Overview
structure given in first source
Names & identifiers
- Preferred name
- N-(9-oxo-9H-fluoren-2-yl)acetamide
- IUPAC
- N-(9-oxofluoren-2-yl)acetamide
- English name
- 2-acetylaminofluoren-9-one
- Molecular formula
- C15H11NO2
- Molecular weight
- 237.25
Names & synonyms
N-(9-Oxo-9H-fluoren-2-yl)acetamide3096-50-2N-(9-Oxofluoren-2-yl)acetamide2-Acetylaminofluorenone2-Acetylaminofluoren-9-oneAcetamide, N-(9-oxo-9H-fluoren-2-yl)-QNU02OXK1FNSC-12369NSC-229648AAF-9-oneRefChem:84992N-(9-Oxo-2-fluorenyl)acetamide
Show more names
2-ACETAMIDO-9-FLUORENONEAcetylaminofluorenone, 2-2-Acetylamino-9H-fluorene-9-one2-(Acetylamino)-9H-fluorene-9-one
2-Acetylamino-9-fluorenone9-Oxo-2-fluorenylacetamideACETAMIDE, N-(9-OXO-2-FLUORENYL)-Acetamide, N-(9-oxofluoren-2-yl)-CHEMBL417970WLN: L B656 HVJ EMV1CCRIS 7421NSC 12369
Database identifiers
- CAS
3096-50-2- PubChem CID
- 18355
- DTXSID
DTXSID6021088- ChEMBL
CHEMBL417970- UNII
- QNU02OXK1F
- EC Number
- 668-194-5
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 366
Experimental & physicochemical properties
PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
Melting Point199 °C
Physicochemical properties
- Melting point
- 227 · 227-228 °C
- Boiling point
- 379.79 °C · 379.79°C (rough estimate)
- Density
- 1.1469 · 1.1469 (rough estimate)
- refractive index
- 1.55 · 1.5500 (estimate)
- pka
- 14.48 · 14.48±0.20(Predicted)
- FDA UNII
- 2 OXK1F · QNU02OXK1F
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · 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, P301+P317, P330, 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.
Hazard information
Hazards SummarySee POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety & protection
Protective Action Criteria (PAC)
12 [mg/m3]
130 [mg/m3]
790 [mg/m3]
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Portail Substances Chimiques[email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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