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【求助】2-乙基丙烯醛的性质数据(沸点,密度,分子量之外的)求助!!!
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xzliucheng
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2楼2009-11-16 19:29:07
xzliucheng
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你去： http://webbook.nist.gov/cgi/cboo ... Mask=4#Thermo-Phase 或者http://world.chem-db.com/cgi-bin ... mp;mat_ID=MT0016755 http://webbook.nist.gov/cgi/cboo ... ;Mask=200#Mass-Spec 看看 Quantity Value Units Method Reference Comment Tboil 365.7 K N/A Aldrich Chemical Company Inc., 1990 BS Quantity Value Units Method Reference Comment ΔvapH° 36.81 ± 0.41 kJ/mol C Van-chin-syan, Kochubei, et al., 1996 ALS ΔvapH° 36.8 kJ/mol N/A Van-chin-syan, Kochubei, et al., 1996 DRB [ Last edited by xzliucheng on 2009-11-16 at 19:38 ] |
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lezailyf
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用 scifinder scholar 查到的 Experimental Property Values Registry Number: 922-63-4 _ Formula: C5 H8 O CA Index Name: Butanal, 2-methylene- Property Value Condition Note Boiling Point 93.5-94.2 癈 Press: 762 Torr (1) CAS Boiling Point 92.5-93.0 癈 (2) CAS Boiling Point 92.5 癈 (3) SRC Boiling Point 92.3 癈 (4) CAS Boiling Point 91-92 癈 (5) CAS Boiling Point 91-92 癈 (6) CAS Boiling Point 75-82 癈 (7) CAS Boiling Point 71-74 癈 Press: 580 Torr (8) CAS Boiling Point 36-37 癈 Press: 25 Torr (9) CAS Density 0.849 g/cm3 Temp: 20 癈 (4) CAS Density 0.8471 g/cm3 Temp: 20 癈 (1) CAS IR Absorption Spectrum See spectrum (10) WSS logP See full text (11) CAS logP See full text (12) CAS Refractive Index 1.4242 Wavlen: 589.3 (1) CAS nm Temp: 20 癈 Refractive Index 1.4231 Wavlen: 589.3 (4) CAS nm Temp: 20 癈 Refractive Index 1.4207 Wavlen: 589.3 (6) CAS nm Temp: 20 癈 Refractive Index 1.4205 Wavlen: 589.3 (5) CAS nm Temp: 20 癈 Notes: (1) Ioffe, B. V.; Zhurnal Organicheskoi Khimii 1967, V3(6), P988-93 (2) Schulz, H.; Angewandte Chemie 1950, V62, P105-18 (3) "PhysProp" data are provided by Syracuse Research Corporation of Syracuse, New York (US) (4) Farberov, M. I.; Zhurnal Prikladnoi Khimii (Sankt-Peterburg, Russian Federation) 1962, V35, P2483-91 (5) Marvel, C. S.; Journal of the American Chemical Society 1948, V70, P1694-9 (6) Chumakov, Yu. I.; Metody Polucheniya Khimicheskikh Reaktivov i Preparatov 1965, VNo. 13, P134-9 (7) Brown, Robert W.; Journal of Organic Chemistry 1948, V13, P173-8 (8) Kissinger, L. W.; Nitro Compounds, Proceedings of the International Symposium 1964, V1963, P317-23 (9) Green, M. B.; Journal of the Chemical Society 1957, P3262-70 (10) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US) (11) Schultz, T. Wayne; Chemical Research in Toxicology 2005, V18(2), P330-341 (12) Benigni, Romualdo; Environmental and Molecular Mutagenesis 2005, V46(4), P268-280 Database: REGISTRY |
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lezailyf
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Predicted Property Values Registry Number: 922-63-4 _ Formula: C5 H8 O CA Index Name: Butanal, 2-methylene- Property Value Condition Note Bioconcentration 3.85 pH 1 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 2 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 3 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 4 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 5 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 6 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 7 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 8 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 9 (13) Factor Temp: 25 癈 Bioconcentration 3.85 pH 10 (13) Factor Temp: 25 癈 Boiling Point 92.5?.0 癈 Press: 760 Torr (13) Carbon-13 NMR See spectrum (14) Spectrum Density 0.814?.06 g/cm3 Temp: 20 癈 (13) Press: 760 Torr Enthalpy of 33.23?.0 kJ/mol Press: 760 Torr (13) Vaporization Flash Point 1.1?.0 癈 (13) Freely Rotatable Bonds 2 (13) H Acceptors 1 (13) H Donors 0 (13) H Donor/Acceptor Sum 1 (13) Koc 91.4 pH 1 (13) Temp: 25 癈 Koc 91.4 pH 2 (13) Temp: 25 癈 Koc 91.4 pH 3 (13) Temp: 25 癈 Koc 91.4 pH 4 (13) Temp: 25 癈 Koc 91.4 pH 5 (13) Temp: 25 癈 Koc 91.4 pH 6 (13) Temp: 25 癈 Koc 91.4 pH 7 (13) Temp: 25 癈 Koc 91.4 pH 8 (13) Temp: 25 癈 Koc 91.4 pH 9 (13) Temp: 25 癈 Koc 91.4 pH 10 (13) Temp: 25 癈 logD 1.07 pH 1 (13) Temp: 25 癈 logD 1.07 pH 2 (13) Temp: 25 癈 logD 1.07 pH 3 (13) Temp: 25 癈 logD 1.07 pH 4 (13) Temp: 25 癈 logD 1.07 pH 5 (13) Temp: 25 癈 logD 1.07 pH 6 (13) Temp: 25 癈 logD 1.07 pH 7 (13) Temp: 25 癈 logD 1.07 pH 8 (13) Temp: 25 癈 logD 1.07 pH 9 (13) Temp: 25 癈 logD 1.07 pH 10 (13) Temp: 25 癈 logP 1.074?.318 Temp: 25 癈 (13) Mass Intrinsic Solubility Soluble (26 g/L) Temp: 25 癈 (13) Mass Solubility Soluble (26 g/L) pH 1 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 2 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 3 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 4 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 5 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 6 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 7 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 8 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 9 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) pH 10 (13) Temp: 25 癈 Mass Solubility Soluble (26 g/L) Unbuffered (13) Water pH 7.00 Temp: 25 癈 Molar Intrinsic Soluble (0.31 mol/L) Temp: 25 癈 (13) Solubility Molar Solubility Soluble (0.31 mol/L) pH 1 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 2 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 3 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 4 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 5 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 6 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 7 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 8 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 9 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) pH 10 (13) Temp: 25 癈 Molar Solubility Soluble (0.31 mol/L) Unbuffered (13) Water pH 7.00 Temp: 25 癈 Molar Volume 103.2?.0 cm3/mol Temp: 20 癈 (13) Press: 760 Torr Molecular Weight 84.12 (13) Polar Surface Area 17.1 A2 (13) Proton NMR Spectrum See spectrum (14) Vapor Pressure 51.5 Torr Temp: 25 癈 (13) Notes: (13) Calculated using Advanced Chemistry Development (ACD/Labs) Software V9.04 for Solaris ( 1994-2009 ACD/Labs) (14) Predicted NMR data calculated using Advanced Chemistry Development, Inc. (ACD/Labs) Software V9.07 ( 1994-2009 ACD/Labs) Database: REGISTRY |
6楼2009-11-16 21:03:45
7楼2009-11-18 09:55:29
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