Substance
- Substance Name: dienogest
- Formula: C20H25NO2
- Molecular Weight: 311.4 g/mol
- Identifiers:
- inchi: InChI=1S/C20H25NO2/c1-19-8-6-16-15-5-3-14(22)12-13(15)2-4-17(16)18(19)7-9-20(19,23)10-11-21/h12,17-18,23H,2-10H2,1H3/t17-,18+,19+,20-/m1/s1
- inchikey: AZFLJNIPTRTECV-FUMNGEBKSA-N
- casrn: 65928-58-7
- csmiles: CC12CCC3=C4CCC(=O)C=C4CCC3C1CCC2(CC#N)O
- ismiles: C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(CC#N)O
- pubchemId: 68861
- iupacname: 2-[(8S,13S,14S,17R)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]acetonitrile
- wikidataId: Q139160
- chemspiderId: 62093
- dsstoxcmpId: DTXCID101030584
- chemblId: CHEMBL1201864
- ecnumber: 639-448-2
dienogest
Systems and Datasets
- dienogest (Datasets: 2)
- Dataset 1 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 1, Quantity: Triple point temperature)
- Dataset 2 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 1, Quantity: Molar enthalpy of transition or fusion)
- dienogest + 2-methoxy-2-methylpropane (Datasets: 1)
- Dataset 3 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + propan-1-ol (Datasets: 1)
- Dataset 4 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + tetrahydrofuran (Datasets: 1)
- Dataset 5 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + ethanol (Datasets: 1)
- Dataset 6 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + ethyl acetate (Datasets: 1)
- Dataset 7 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + propan-2-ol (Datasets: 1)
- Dataset 8 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + acetone (Datasets: 1)
- Dataset 9 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + acetonitrile (Datasets: 1)
- Dataset 10 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + dimethylformamide (Datasets: 1)
- Dataset 11 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + methanol (Datasets: 1)
- Dataset 12 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + water (Datasets: 1)
- Dataset 13 in paper 10.1021/acs.jced.9b00696 (Dataseries: 1, Datapoints: 10, Quantity: Mole fraction)
- dienogest + methanol + water (Datasets: 1)
- Dataset 14 in paper 10.1021/acs.jced.9b00696 (Dataseries: 10, Datapoints: 110, Quantity: Mole fraction)