Substance
- Substance Name: benflumetol
- Formula: C30H32Cl3NO
- Molecular Weight: 528.9 g/mol
- Identifiers:
- inchi: InChI=1S/C30H32Cl3NO/c1-3-5-13-34(14-6-4-2)19-29(35)28-18-23(33)17-27-25(15-20-7-9-21(31)10-8-20)26-16-22(32)11-12-24(26)30(27)28/h7-12,15-18,29,35H,3-6,13-14,19H2,1-2H3/b25-15-
- inchikey: DYLGFOYVTXJFJP-MYYYXRDXSA-N
- casrn: 82186-77-4
- csmiles: CCCCN(CCCC)CC(C1=CC(=CC2=C1C3=C(C2=CC4=CC=C(C=C4)Cl)C=C(C=C3)Cl)Cl)O
- ismiles: CCCCN(CCCC)CC(C1=CC(=CC\2=C1C3=C(/C2=C/C4=CC=C(C=C4)Cl)C=C(C=C3)Cl)Cl)O
- pubchemId: 6437380
- iupacname: 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]fluoren-4-yl]ethanol
- wikidataId: Q904464
- chemspiderId: 4941944
- dsstoxcmpId: DTXCID1026663
- chemblId: CHEMBL38827
- ecnumber: 617-303-4
benflumetol
Systems and Datasets
- benflumetol + carbon dioxide (Datasets: 1)
- Dataset 2 in paper 10.1021/acs.jced.8b00388 (Dataseries: 3, Datapoints: 18, Quantity: Mass ratio of solute to solvent)