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CAS No.: | 204589-80-0 |
---|---|
Name: | Methyl (3R,4S)-1-(4-fluorophenyl)-2-oxo-4-[4-(phenylmethoxy)phenyl]-3-azetidinepropanoate |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C26H24 F N O4 |
Molecular Weight: | 433.479 |
Synonyms: | 3-Azetidinepropanoicacid, 1-(4-fluorophenyl)-2-oxo-4-[4-(phenylmethoxy)phenyl]-, methyl ester,(3R-trans)-; |
EINECS: | 606-560-8 |
Density: | 1.239 g/cm3 |
Boiling Point: | 628.309 °C at 760 mmHg |
Flash Point: | 333.789 °C |
PSA: | 55.84000 |
LogP: | 5.12700 |
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The Methyl (3R,4S)-1-(4-fluorophenyl)-2-oxo-4-[4-(phenylmethoxy)phenyl]-3-azetidinepropanoate , with the CAS register number 204589-80-0, is also known to us as 3-Azetidinepropanoic acid, 1-(4-fluorophenyl)-2-oxo-4-[4-(phenylmethoxy)phenyl]-, methyl ester, (3R,4S)- and Methyl 3-[(2S,3R)-2-[4-(benzyloxy)phenyl]-1-(4-fluorophenyl)-4-oxoazetidin-3-yl]propanoate .
The physical properties of this kind of chemcial are as followings:(1)ACD/BCF (pH 5.5): 1858 ; (2)ACD/BCF (pH 7.4): 1858 ; (3)ACD/KOC (pH 5.5): 7614 ; (4)ACD/KOC (pH 7.4): 7614 ; (5)#H bond acceptors: 5 ; (6)#Freely Rotating Bonds: 9 ; (7)Polar Surface Area: 55.84 ; (8)Index of Refraction: 1.589 ; (9)Molar Refractivity: 117.948 cm3 ; (10)Molar Volume: 349.887 cm3 ; (11)Polarizability: 46.758 ×10-24 cm3 ; (12)Surface Tension: 48.051 dyne/cm ; (13)Density: 1.239 g/cm3 ; (14)Flash Point: 333.789 °C ; (15)Enthalpy of Vaporization: 92.971 kJ/mol ; (16)Boiling Point: 628.309 °C at 760 mmHg .
In addition, you could refer to the following data information to get the molecular structure:
SMILES:Fc1ccc(cc1)N4C(=O)[C@@H]([C@H]4c3ccc(OCc2ccccc2)cc3)CCC(=O)OC
InChI:InChI=1/C26H24FNO4/c1-31-24(29)16-15-23-25(28(26(23)30)21-11-9-20(27)10-12-21)19-7-13-22(14-8-19)32-17-18-5-3-2-4-6-18/h2-14,23,25H,15-17H2,1H3/t23-,25-/m1/s1
InChIKey:KYSALESRYJDXBT-ILBGXUMGBE
What's more, if you need to know the market information of this chemical, there are many suppliers in China, such as Ningbo Hi-Tech Biochemicals Co., Ltd and Yancheng Henz Chemical Co., Ltd.