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P-chloro mandelic acid

Catalog No: FT-0693821

CAS No: 7138-34-3

Chemical Name: P-chloro mandelic acid
Molecular Formula: C8H7ClO3
Molecular Weight: 186.59
InChI Key: BWSFWXSSALIZAU-UHFFFAOYSA-N
InChI: InChI=1S/C8H7ClO3/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,10H,(H,11,12)

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

FW:	186.59200
CAS:	7138-34-3
Melting_Point:	114-118 °C
Bolling_Point:	N/A
MF:	C8H7ClO3
Product_Name:	4-Chloromandelic acid
Flash_Point:	N/A
Density:	N/A

FW:	186.59200
MF:	C8H7ClO3
Computational_Chemistry:	['1 . XlogP 12 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 3 ', '4 . Rotatable Bond Count 2 ', '5 . TPSA 575 ', '6 . Heavy Atom Count 12 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 164 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 1 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
LogP:	1.45800
More_Info:	['1 . Appearance White 针状结晶。 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）119-122 ', '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 Soluble in Ethanol Ethyl ether and 热苯，略Soluble in Water ，微Soluble in 冷苯and 二硫化碳。']
PSA:	57.53000
Melting_Point:	114-118 °C
Exact_Mass:	186.00800
Molecular_Structure:	['1 . Molar refractive index 4379 ', '2 . Molar volume （m3/mol）1270 ', '3 . Parachor （902K）3569 ', '4 . Surface tension 622 5 . Polarizability （ 10', '-24cm', '3 ） 1736']