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Name |
Benzoic acid, 2-chloro-, sodium salt |
EINECS | 241-297-9 |
CAS No. | 17264-74-3 | Density | N/A |
PSA | 40.13000 | LogP | 0.70350 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H4ClNaO2 | Boiling Point | 275.7 °C at 760 mmHg |
Molecular Weight | 178.55 | Flash Point | 120.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Benzoicacid, 2-chloro-, sodium salt (9CI);Benzoic acid, o-chloro-, sodium salt (8CI);Sodium 2-chlorobenzoate;Sodium o-chlorobenzoate;o-Chlorobenzoic acid sodiumsalt; |
Article Data | 2 |
4-nitrophenol sodium salt
ortho-chlorobenzoic acid
A
4-nitro-phenol
B
sodium 2-chlorobenzoate
Conditions | Yield |
---|---|
With 1-butyl-2,3-dimethylimidazolium bis-(trifluoromethanesulfonyl)amide In methanol at 24.84℃; Equilibrium constant; Reagent/catalyst; |
bis(cyclopentadienyl)titanium dichloride
sodium 2-chlorobenzoate
Conditions | Yield |
---|---|
In water; acetylacetone addn. of 2 mmol (C5H5)2TiCl2 to water containing acetylacetone; stirring for 2 h; dropwise addn. of an aq. soln. 5.2 mmol o-ClC6H4CO2Na; filtration;; dissolving in CH2Cl2 soln.; drying with anhydrous CaCl2 for 2 h; distillation of solvent in vac.; recrystallization from CH2Cl2-hexane; elem. anal.;; | 93% |
In benzene mixt. of complex and Na-salt of benzoic acid in dry benzene was stirredfor 3-8 h at 30°C; filtered, filtrate was evapd., recrystd. from boiling benzene; elem. anal.; | 62% |
In benzene a mixt. of (η-C5H5)2TiCl2 and Na salt of the substituted benzoic acid in anhydrous benzene stirred at 30°C for 4 h; orange soln. filtered, concd., crystn. (refrigerator), recrystd. (benzene); | 48% |
In not given |
dichlorobis(η5-methylcyclopentadienyl)titanium(IV)
sodium 2-chlorobenzoate
Conditions | Yield |
---|---|
In water; acetylacetone addn. of 2 mmol (C5H4CH3)2TiCl2 to water containing acetylacetone; stirring for 2 h; dropwise addn. of an aq. soln. 5.2 mmol o-ClC6H4CO2Na; filtration;; dissolving in CH2Cl2 soln.; drying with anhydrous CaCl2 for 2 h; distillation of solvent in vac.; recrystallization from CH2Cl2-hexane; elem. anal.;; | 92% |
C12H11BrO3
sodium 2-chlorobenzoate
4-(2-(2-chlorophenylformyloxyl)ethoxy)-3-phenylfuran-2(5H)-one
Conditions | Yield |
---|---|
In dimethyl sulfoxide at 20℃; | 86.5% |
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide at 90 - 95℃; | 85% |
Conditions | Yield |
---|---|
at 20℃; for 2h; | 83% |
pyridine-4-carbonitrile
sodium 2-chlorobenzoate
Conditions | Yield |
---|---|
In water for 168h; | 82.01% |
Conditions | Yield |
---|---|
tetrabutyl phosphonium bromide at 150℃; under 20 Torr; g.l.p.t.c.; | 78% |
pyridine-3-carbonitrile
water
sodium 2-chlorobenzoate
zinc(II) chloride
Conditions | Yield |
---|---|
at 20℃; for 2h; | 78% |
Conditions | Yield |
---|---|
at 20℃; for 2h; | 74% |
The Benzoic acid, 2-chloro-, sodium salt is an organic compound with the formula C7H4ClNaO2. The IUPAC name of this chemical is Sodium 2-chlorobenzoate. With the CAS registry number 17264-74-3, it is also named as 2-Chlorobenzoic acid sodium salt. Besides, its molecular weight is 178.55.
Physical properties about Benzoic acid, 2-chloro-, sodium salt are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): -0.39; (3)ACD/LogD (pH 7.4): -1.09; (4)ACD/BCF (pH 5.5): 1; (5) ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1.13; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 37.3 Å2; (12)Flash Point: 120.5 °C; (13)Enthalpy of Vaporization: 54.31 kJ/mol; (14)Boiling Point: 275.7 °C at 760 mmHg; (15)Vapour Pressure: 0.00242 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C7H5ClO2.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H,9,10);/q;+1/p-1
(2)InChIKey: OJLSABVGUWNJKD-REWHXWOFAQ
(3)Std. InChI: InChI=1S/C7H5ClO2.Na/c8-6-4-2-1-3-5(6)7(9)10;/h1-4H,(H,9,10);/q;+1/p-1
(4)Std. InChIKey: OJLSABVGUWNJKD-UHFFFAOYSA-M