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Name	Pyridazine,3-chloro-6-(4-methoxyphenyl)-	EINECS	N/A
CAS No.	58059-31-7	Density	1.246 g/cm³
PSA	35.01000	LogP	2.80560
Solubility	N/A	Melting Point	160 °C
Formula	C₁₁H₉ClN₂O	Boiling Point	407.764 °C at 760 mmHg
Molecular Weight	220.658	Flash Point	200.409 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	Xi
Synonyms	Pyridazine,3-chloro-6-(p-methoxyphenyl)- (7CI);3-Chloro-6-(4-methoxyphenyl)pyridazine;	Article Data	12

Pyridazine,3-chloro-6-(4-methoxyphenyl)- Synthetic route

: 2166-33-8
6-(4-methoxyphenyl)-2H-pyridazin-3-one

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With isocyanate de chlorosulfonyle In acetonitrile at 60 - 65℃; for 3.5h;	82%
With trichlorophosphate at 85 - 95℃; for 4h;
With trichlorophosphate Heating;

: 33397-21-6
tris(4-methoxyphenyl)bismuth

: 135034-10-5
3-chloro-6-iodopyridazine

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With palladium diacetate; triphenylphosphine In N,N-dimethyl-formamide at 90℃; for 4h; Catalytic behavior; Reagent/catalyst; Inert atmosphere; chemoselective reaction;	82%

: 5720-07-0
4-methoxyphenylboronic acid

: 135034-10-5
3-chloro-6-iodopyridazine

A: 2166-07-6
3,6-bis-(4-methoxyphenyl)-pyridazine

B: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0); caesium carbonate In 1,4-dioxane Suzuki Coupling; Heating; Inert atmosphere; chemoselective reaction;	A 15% B 70%

: 141-30-0
3,6-dichlorpyridazine

: 5720-07-0
4-methoxyphenylboronic acid

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With tetrakis(triphenylphosphine) palladium(0); caesium carbonate In 1,4-dioxane Suzuki Coupling; Heating; Inert atmosphere; chemoselective reaction;	58%
With potassium phosphate tribasic trihydrate; (2-mesityl-1H-inden-3-yl)dicyclohexyl phosphine; palladium diacetate; Aliquat 336 In water at 20 - 100℃; for 8h; Suzuki-Miyaura Coupling; Inert atmosphere;	43%
With sodium carbonate; tetrakis(triphenylphosphine) palladium(0) In ethanol; water; toluene at 80℃; for 16h;

: 141-30-0
3,6-dichlorpyridazine

: 33397-21-6
tris(4-methoxyphenyl)bismuth

A: 2132-80-1
4,4'-Dimethoxybiphenyl

B: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With palladium diacetate; triphenylphosphine; cesium fluoride In N,N-dimethyl-formamide at 90℃; Inert atmosphere; chemoselective reaction;	A 17 %Chromat. B 43%

: 2166-33-8
6-(4-methoxy-phenyl)-2H-pyridazin-3-one

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With trichlorophosphate at 0℃; for 6h; Heating / reflux;	40%

: 141-30-0
3,6-dichlorpyridazine

: 93296-09-4
4-methoxyphenylzinc chloride

A: 2166-07-6
3,6-bis-(4-methoxyphenyl)-pyridazine

B: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
tetrakis(triphenylphosphine) palladium(0) In tetrahydrofuran at 20℃; for 24h;

: 141-30-0
3,6-dichlorpyridazine

: 33397-21-6
tris(4-methoxyphenyl)bismuth

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With palladium diacetate; triphenylphosphine; cesium fluoride In N,N-dimethyl-formamide at 90℃; Reagent/catalyst; Inert atmosphere; chemoselective reaction;

: C11H12N2O2

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
With trichlorophosphate

: 100-06-1
1-(4-methoxyphenyl)ethanone

: 58059-31-7
3-chloro-6-(4-methoxyphenyl)pyridazine

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1.1: acetic acid / Reflux 1.2: 2 h / Reflux 2.1: trichlorophosphate / Heating View Scheme

Pyridazine,3-chloro-6-(4-methoxyphenyl)- Specification

The Pyridazine, 3-chloro-6-(4-methoxyphenyl)-, with the CAS registry number of 58059-31-7, is also known as Pyridazine, 3-chloro-6-(p-methoxyphenyl)- (7CI). This chemical's molecular formula is C₁₁H₉ClN₂O and molecular weight is 220.65. What's more, its systematic name is called 3-Chloro-6-(4-methoxyphenyl)pyridazine.

Physical properties about Pyridazine, 3-chloro-6-(4-methoxyphenyl)- are: (1)ACD/LogP: 2.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 11; (6)ACD/BCF (pH 7.4): 11; (7)ACD/KOC (pH 5.5): 188; (8)ACD/KOC (pH 7.4): 188; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.01 Å²; (13)Index of Refraction: 1.576; (14)Molar Refractivity: 58.601 cm³; (15)Molar Volume: 177.119 cm³; (16)Surface Tension: 46.079 dyne/cm; (17)Density: 1.246 g/cm³; (18)Flash Point: 200.409 °C; (19)Enthalpy of Vaporization: 63.404 kJ/mol; (20)Boiling Point: 407.764 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: COc1ccc(cc1)c2ccc(Cl)nn2
(2) InChI: InChI=1/C11H9ClN2O/c1-15-9-4-2-8(3-5-9)10-6-7-11(12)14-13-10/h2-7H,1H3
(3) InChIKey: TZBSFHQGJIBFLX-UHFFFAOYAX

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