Chemical Properties of 17Beta-acetoxy-2,4-dibromoestra-1,3,5(10)-trien-3-ol (CAS 95946-09-1)

17Beta-acetoxy-2,4-dibromoestra-1,3,5(10)-trien-3-ol

PDF Excel Molecule Calculator
InChI
InChI=1S/C20H24Br2O3/c1-10(23)25-17-6-5-15-12-3-4-13-14(9-16(21)19(24)18(13)22)11(12)7-8-20(15,17)2/h9,11-12,15,17,24H,3-8H2,1-2H3
InChI Key
YGDGJBWJHHTLMF-UHFFFAOYSA-N
Formula
C20H24Br2O3
SMILES
CC(=O)OC1CCC2C3CCc4c(cc(Br)c(O)c4Br)C3CCC12C
Molecular Weight1
472.21
CAS
95946-09-1
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf -21.72 kJ/mol Joback Calculated Property
Δfgas -442.82 kJ/mol Joback Calculated Property
Δfus 45.62 kJ/mol Joback Calculated Property
Δvap 97.73 kJ/mol Joback Calculated Property
log10WS -7.03 Crippen Calculated Property
logPoct/wat 5.705 Crippen Calculated Property
McVol 284.630 ml/mol McGowan Calculated Property
Pc 2267.57 kPa Joback Calculated Property
Tboil 1007.51 K Joback Calculated Property
Tc 1271.45 K Joback Calculated Property
Tfus 744.82 K Joback Calculated Property
Vc 1.012 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [939.04; 1113.48] J/mol×K [1007.51; 1271.45] Show Hide
Cp,gas 939.04 J/mol×K 1007.51 Joback Calculated Property
Cp,gas 963.34 J/mol×K 1051.50 Joback Calculated Property
Cp,gas 989.00 J/mol×K 1095.49 Joback Calculated Property
Cp,gas 1016.45 J/mol×K 1139.48 Joback Calculated Property
Cp,gas 1046.07 J/mol×K 1183.47 Joback Calculated Property
Cp,gas 1078.28 J/mol×K 1227.46 Joback Calculated Property
Cp,gas 1113.48 J/mol×K 1271.45 Joback Calculated Property

Similar Compounds

1,3,5(10)-Oestratriene-3,17«beta»-diol, 3-TBDMS-17-HFB. Estriol, 3-(tert-butyldimethylsilyl) ether. Retroisosenine. Thymidine, 3'-O-acetyl, 5'-O-TBDMS. Nalmefene, bis(trifluoroacetate). Retroisosensine. azadirachtin. Benzquinamide M (O-des-Et), acetylated. «delta»1-tetrahydrocannabinolic acid, phenyl-boronate. «beta»-Estradiol, 3-(tert-butyldimethylsilyl) ether. (1R,9S)-1-Acetoxy-N-acetyl-1,9-dihydro-anhydronornarceine. Codeine-propionyl. Acenaphthene-cis-1,2-diol, 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Galantamin. Etorphine.

Find more compounds similar to 17Beta-acetoxy-2,4-dibromoestra-1,3,5(10)-trien-3-ol.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.