7-[(3R)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoic acid

Catalog No: FT-0771587

CAS No: 54996-33-7

Chemical Name: 7-[(3R)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoic acid
Molecular Formula: C12H18O4
Molecular Weight: 226.27
InChI Key: IXOFUWJRSYPKSX-JTQLQIEISA-N
InChI: InChI=1S/C12H18O4/c13-10-7-9(11(14)8-10)5-3-1-2-4-6-12(15)16/h7,10,13H,1-6,8H2,(H,15,16)/t10-/m0/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:	444.3ºC at 760 mmHg
CAS:	54996-33-7
MF:	C12H18O4
Density:	1.202g/cm3
Melting_Point:	40-43ºC(lit.)
Product_Name:	7-[(3R)-3-hydroxy-5-oxocyclopenten-1-yl]heptanoic acid
Flash_Point:	>230 °F
FW:	226.26900

MF:	C12H18O4
Density:	1.202g/cm3
Computational_Chemistry:	['1. XlogP :12 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :2 ', '6. TPSA 746 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :293 ', '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 Solid ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）40-43 ', '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）>113 ', '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:	226.12100
Flash_Point:	>230 °F
PSA:	74.60000
Molecular_Structure:	['1 . Molar refractive index 5830 ', '2 . Molar volume 1917 ', '3 . Parachor （902K）5021 ', '4 . Surface tension 470 ', '5 . Polarizability 2311 ', '6 . Dielectric constant 未确定']
LogP:	1.67170
Bolling_Point:	444.3ºC at 760 mmHg
FW:	226.26900
Refractive_Index:	1.533
Melting_Point:	40-43ºC(lit.)

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
HS_Code:	2918990090
WGK_Germany:	3
RIDADR:	NONH for all modes of transport