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3-(P-CHLOROBENZOYL)-BUTYRIC ACID

Catalog No: FT-0639353

CAS No: 36978-49-1

Chemical Name: 3-(P-CHLOROBENZOYL)-BUTYRIC ACID
Molecular Formula: C11H11ClO3
Molecular Weight: 226.65
InChI Key: BVLILROMUFYKGH-UHFFFAOYSA-N
InChI: InChI=1S/C11H11ClO3/c12-9-6-4-8(5-7-9)10(13)2-1-3-11(14)15/h4-7H,1-3H2,(H,14,15)

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

Melting_Point:	82-83ºC
CAS:	36978-49-1
MF:	C11H11ClO3
Flash_Point:	200.3ºC
Product_Name:	5-(4-chlorophenyl)-5-oxopentanoate
Density:	1.277g/cm3
FW:	226.65600
Bolling_Point:	407.6ºC at 760 mmHg

Refractive_Index:	1.55
Flash_Point:	200.3ºC
LogP:	2.63350
Bolling_Point:	407.6ºC at 760 mmHg
PSA:	54.37000
Molecular_Structure:	['1 . Molar refractive index 5659 ', '2 . Molar volume （m3/mol）1774 ', '3 . Parachor （902K）4668 ', '4 . Surface tension 479 ', '5 . Polarizability （10 -24cm 3）2243']
Computational_Chemistry:	['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :2 ', '6. TPSA 572 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :-1 ', '9. Complexity :227 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	82-83ºC
MF:	C11H11ClO3
Exact_Mass:	226.04000
FW:	226.65600
Density:	1.277g/cm3
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）124-129 ', '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']