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[ CAS No. 91552-11-3 ]

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2D
Chemical Structure| 91552-11-3
Chemical Structure| 91552-11-3
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Product Details of [ 91552-11-3 ]

CAS No. :91552-11-3MDL No. :MFCD11935567
Formula : C10H9ClO2 Boiling Point : 345.9±42.0°C at 760 mmHg
Linear Structure Formula :-InChI Key :-
M.W :196.63Pubchem ID :23423018
Synonyms :

Computed Properties of [ 91552-11-3 ]

TPSA : 37.3 H-Bond Acceptor Count : 2
XLogP3 : 2.3 H-Bond Donor Count : 1
SP3 : 0.30 Rotatable Bond Count : 2

Safety of [ 91552-11-3 ]

Signal Word:WarningClass:N/A
Precautionary Statements:P280-P305+P351+P338UN#:N/A
Hazard Statements:H302Packing Group:N/A
GHS Pictogram:

Application In Synthesis of [ 91552-11-3 ]

  • Downstream synthetic route of [ 91552-11-3 ]

[ 91552-11-3 ] Synthesis Path-Downstream   1~1

YieldReaction ConditionsOperation in experiment
m-Chlorstyrol, Ethyldiazoacetat;
26.c c) c) (1R-trans)-2-(3-Chlorophenyl)-cyclopropane carboxylic acid The subtitle compound was prepared according to the method of example 19, step (h) using the product of step (b). MS (APCI) 195/197 (M-H+), 195 (100%)
2 1-[2-(3-Chloro-phenyl)-cyclopropyl]-3-[4-(6-morpholin-4-ylmethyl-pyridin-3-yl)-naphthalen-1-yl]-urea The crude cyclopropanated ester from above (1.09 g, 5.17 mmol) was dissolved in 30 mL MeOH and treated with 15 mL of 2 M aqueous NaOH solution. The mixture was stirred at room temperature for 2 h. It was then placed on a rotary evaporator to remove the MeOH. The remaining solution was diluted with water (30 mL), washed with ether (15 mL), then acidified with 5 M aqueous HCl solution. The product was extracted with ether (3*40 mL) and the combined organics were washed with brine and dried (MgSO4). After filtration, the solvents were removed in vacuo to afford 792 mg of 2-(3-chlorophenyl)-cyclopropanecarboxylic acid as a white solid (4.03 mmol, 78% yield).
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