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477313-09-0

Basic Information
CAS No.: 477313-09-0
Name: (+/-)-AC 7954 HYDROCHLORIDE
Molecular Structure:
Molecular Structure of 477313-09-0 ((+/-)-AC 7954 HYDROCHLORIDE)
Formula: C19H21Cl2NO2
Molecular Weight: 366.2815
Synonyms: 3-(4-Chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1H-isochromen-1-one hydrochloride;
Boiling Point: 462.8 °C at 760 mmHg
Flash Point: 233.7 °C
Solubility: H2O: ~28 mg/mL
Appearance: white solid
PSA: 29.54000
LogP: 4.70210
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  • (±)-AC 7954 hydrochloride

  • Casno:

    477313-09-0

    (±)-AC 7954 hydrochloride

    Purity: 98%

    FOB Price:  USD $ 0 / g

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    MeiKe meditech is a company specialized on medicine intermediate and chemical medicine impurity research & development and manufacturing. MeiKe has a professional R&D team

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  • 1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride (1:1)

  • Casno:

    477313-09-0

    1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride (1:1)

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Henan Wentao Chemical Product Co.,Ltd is Located in Zhengzhou High-tech Development Zone with import and export license, We passed ISO 9001:2008 as well, Henan Wentao has developed more than 1000 compounds, which are widely used in the fields of prod

    The company is Located in Zhengzhou High-tech Development Zone with import and export license, We passed ISO 9001:2008 as well, Henan Wentao has developed more than 1000 compounds,

  •  Henan Wentao Chemical Product Co., Ltd.

     China (Mainland)  |  Contact Details

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  • (±)-AC 7954 hydrochloride

  • Casno:

    477313-09-0

    (±)-AC 7954 hydrochloride

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

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Specification

The 1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride (1:1), with the CAS registry number 477313-09-0, is also known as 3-(4-Chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-1H-isochromen-1-one hydrochloride. This chemical's molecular formula is C19H21Cl2NO2 and molecular weight is 366.2815. What's more, it should be stored under the temperature of +4 °C and it is white solid.

Physical properties about 1H-2-Benzopyran-1-one,3-(4-chlorophenyl)-3-[2-(dimethylamino)ethyl]-3,4-dihydro-,hydrochloride (1:1) are: (1)ACD/LogP: 4.13; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 11; (7)ACD/KOC (pH 5.5): 4; (8)ACD/KOC (pH 7.4): 55; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 29.54 Å2; (13)Flash Point: 233.7 °C; (14)Enthalpy of Vaporization: 72.39 kJ/mol; (15)Boiling Point: 462.8 °C at 760 mmHg; (16)Vapour Pressure: 9.57E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Cl.Clc1ccc(cc1)C3(OC(=O)c2c(cccc2)C3)CCN(C)C
(2) InChI: InChI=1/C19H20ClNO2.ClH/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19;/h3-10H,11-13H2,1-2H3;1H
(3) InChIKey: AJPGLOWFIBOGMH-UHFFFAOYAX