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methyl 7-[(3S)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoate

Catalog No: FT-0774206

CAS No: 42038-75-5

Chemical Name: methyl 7-[(3S)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoate
Molecular Formula: C13H20O4
Molecular Weight: 240.29
InChI Key: PQKUWAVOSCVDCT-LLVKDONJSA-N
InChI: InChI=1S/C13H20O4/c1-17-13(16)7-5-3-2-4-6-10-8-11(14)9-12(10)15/h8,11,14H,2-7,9H2,1H3/t11-/m1/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Bolling_Point:	378.4±42.0 °C at 760 mmHg
CAS:	42038-75-5
MF:	C13H20O4
Density:	1.1±0.1 g/cm3
Melting_Point:	59-62ºC
Product_Name:	methyl 7-[(3S)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoate
Flash_Point:	138.9±21.4 °C
FW:	240.296

MF:	C13H20O4
Density:	1.1±0.1 g/cm3
Computational_Chemistry:	['1. XlogP :15 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :2 ', '6. TPSA 636 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :307 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :1 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）56-92 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Exact_Mass:	240.136154
Vapor_Pressure:	0.0±1.9 mmHg at 25°C
Flash_Point:	138.9±21.4 °C
PSA:	63.60000
Molecular_Structure:	['1 . Molar refractive index 6327 ', '2 . Molar volume 2135 ', '3 . Parachor （902K）5507 ', '4 . Surface tension 442 ', '5 . Polarizability 2508 ', '6 . Dielectric constant 未确定']
LogP:	0.65
Bolling_Point:	378.4±42.0 °C at 760 mmHg
FW:	240.296
Refractive_Index:	1.504
Melting_Point:	59-62ºC