7-Chloro-3-(2-fluorobenzyl)-4(3H)-quinazolinone
Basic information
- CAS
302913-39-9- Standard SMILES
O=c1c2ccc(Cl)cc2ncn1Cc1ccccc1F- InChIKey
TUJYTQLGAYAWQB-UHFFFAOYSA-N- Molecular formula
- C15H10ClFN2O
- Average molar mass
- 288.7 g/mol
- Monoisotopic mass
- 288.0465688
Names & identifiers
- Preferred name
- 7-Chloro-3-(2-fluorobenzyl)-4(3H)-quinazolinone
- IUPAC
- 7-chloro-3-[(2-fluorophenyl)methyl]quinazolin-4-one
- English name
- 7-chloro-3-[(2-fluorophenyl)methyl]-3,4-dihydroquinazolin-4-one
- Molecular formula
- C15H10ClFN2O
- Molecular weight
- 288.7041032
Names & synonyms
302913-39-97-CHLORO-3-(2-FLUOROBENZYL)-4(3H)-QUINAZOLINONERefChem:546129658-469-87-Chloro-3-(2-fluorobenzyl)quinazolin-4(3H)-one7-chloro-3-[(2-fluorophenyl)methyl]quinazolin-4-one7-chloro-3-[(2-fluorophenyl)methyl]-3,4-dihydroquinazolin-4-oneAKOS024327095ST50451448
Database identifiers
- CAS
302913-39-9- PubChem CID
- 853042
- EC Number
- 658-469-8
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 403
Physicochemical properties
- 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
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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