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41965-95-1

41965-95-1 Structure

41965-95-1 Structure
IdentificationMore
[Name]

3-CHLORO-4-METHOXYBENZYLAMINE HYDROCHLORIDE
[CAS]

41965-95-1
[Synonyms]

TECO-001
BIO-FARMA BF004393
Avanafil Impurity 68
3-Chloro-4-MehoxyBenzylamine HCL
3-chloro-4-methoxybenzylamineHCl
3-chloro-4-methoxybenzylamine, HC
4-AMINOMETHYL-2-CHLOROANISOLE HCL
3-Chloro-4-methoxybenzylamineHCl95%
1-Chloro-4-methoxybenzenemethanamine
3-chloro-4-MethoxybenzylaMniehydrochloride
3-CHLORO-4-METHOXYBENZYLAMINE HYDROCHLORIDE
4-AMINOMETHYL-2-CHLOROANISOLE HYDROCHLORIDE
3-Chloro-4-methoxybenzylaminehydrochloride95%
3-Chloro-4-methoxybenzylamineHydrochloride>
3-chloro-4-methoxybenzylamine hydrochloric acid
3-Chloro-4-methoxybenzylamine hydrochloride 95%
(3-chloro-4-methoxyphenyl)methylammonium chloride
3-chloro-4-methoxyphenyl)methanaminium hydrochlor
3-Chloro-4-MethoxybenzeneMethanaMine hydrochloride
(3-chloro-4-Methoxyphenyl)MethanaMine hydrochloride
(3-chloro-4-methoxyphenyl) methylamine hydrochloride
(3-chloro-4-Methoxyphenyl)MethanaMiniuM hydrochloride
1-(3-chloro-4-methoxyphenyl)methanamine Hydrochloride
BenzeneMethanaMine, 3-chloro-4-Methoxy-, hydrochloride
3-chloro-4-methoxy-Benzenemethanamine hydrochloride (1:1)
BenzeneMethanaMine, 3-chloro-4-Methoxy-, hydrochloride (1:1)
3-CHLORO-4-METHOXYBENZYLAMINE HYDROCHLORIDE ISO 9001:2015 REACH
3-chloro-4-methoxybenzylamine hydrochloride(AvanafilIntermediates)
(3-chloro-4-methoxyphenyl)methanamine hydrochloride in stock Factory
Avanafil intermediates,(3-chloro-4- methoxyphenyl)methanaminium hydrochloride
[EINECS(EC#)]

609-972-6
[Molecular Formula]

C8H11Cl2NO
[MDL Number]

MFCD01211460
[Molecular Weight]

208.09
[MOL File]

41965-95-1.mol
Chemical PropertiesBack Directory
[Melting point ]

250-255 °C (lit.)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

soluble in Methanol
[form ]

Solid
[color ]

White to Almost white
[InChI]

InChI=1S/C8H10ClNO.ClH/c1-11-8-3-2-6(5-10)4-7(8)9;/h2-4H,5,10H2,1H3;1H
[InChIKey]

IKWWOZCEHOYKAO-UHFFFAOYSA-N
[SMILES]

NCC1=CC=C(OC)C(Cl)=C1.[H]Cl
[CAS DataBase Reference]

41965-95-1(CAS DataBase Reference)
Questions And AnswerBack Directory
[Uses]

3-Chloro-4-methoxybenzylamine hydrochloride can be used to synthesize avanafil; it is an intermediate side chain in the synthesis of avanafil.
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

R25:Toxic if swallowed.
R37/38:Irritating to respiratory system and skin .
R41:Risk of serious damage to eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

6.1
[HazardClass ]

IRRITANT
[HS Code ]

2922290090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

White powder solid
[Synthesis]

4-Methoxybenzylamine

2393-23-9

3-CHLORO-4-METHOXYBENZYLAMINE HYDROCHLORIDE

41965-95-1

General procedure for the synthesis of 3-chloro-4-methoxybenzylamine hydrochloride from 4-methoxybenzylamine: acetic acid (100 ml) was slowly added to 4-methoxybenzylamine (100 g) at 25-30 °C. Subsequently, additional acetic acid (750 ml) was added to the reaction mixture. Sulfonyl chloride (87.84 ml) was slowly added dropwise to the reaction mixture at 20-25 °C and stirred continuously for 6 h at the same temperature. After completion of the reaction, methyl tert-butyl ether (850 ml) was added to the reaction mixture at 25-30 °C. The reaction mixture was cooled to 15-20°C and stirring was continued at this temperature for 1 hour. The precipitated solid product was filtered, washed with methyl tert-butyl ether and dried to give 3-chloro-4-methoxybenzylamine hydrochloride. Yield: 118 g.

[References]

[1] Synthesis, 2003, # 3, p. 403 - 407
[2] Synthetic Communications, 2000, vol. 30, # 14, p. 2609 - 2612
[3] Tetrahedron, 2003, vol. 59, # 35, p. 6991 - 7009
[4] Organic letters, 2001, vol. 3, # 25, p. 4063 - 4066
[5] Patent: WO2015/1567, 2015, A1. Location in patent: Page/Page column 21
Spectrum DetailBack Directory
[Spectrum Detail]

3-CHLORO-4-METHOXYBENZYLAMINE HYDROCHLORIDE(41965-95-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

41965-95-1(sigmaaldrich)
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