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128794-94-5

Basic Information
CAS No.: 128794-94-5
Name: Mycophenolate mofetil
Article Data: 2
Molecular Structure:
Molecular Structure of 128794-94-5 (Mycophenolate mofetil)
Formula: C23H31NO7
Molecular Weight: 433.502
Synonyms: Cellcept (TN);RS 61443;2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoate;4-Hexenoic acid,6-(1,3-dihydro-4-hydroxy-6- methoxy-7-methyl-3-oxo-5-isobenzofuranyl)- 4-methyl-,2-(4-morpholinyl)ethyl ester,(4E)-;Mycophenolate;
Density: 1.222 g/cm3
Melting Point: 95-96 °C
Boiling Point: 637.6 °C at 760 mmHg
Flash Point: 339.4 °C
Appearance: White powder
Hazard Symbols: Xn
Risk Codes: 22
Safety: 22
PSA: 94.53000
LogP: 2.46190
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    KAISA GROUP INC.is the enterprise which is specialize in manfacturing and exporting avariety of Chemical in China. We have the strong economic base and comprehensive technology.We

  •  KAISA GROUP INC

    United States  |  Contact Details

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    Address:1312 17th Street Suite 1402 Denver CO 80202

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  • Mycophenolate mofetil

  • Casno:

    128794-94-5

    Mycophenolate mofetil

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    High quality,stable supply chain.Appearance:white/off-white or light yellow Storage:Store in cool and dry place, keep away from strong light and heat. Package:aluminum bottle,glass bottle,PTFE bottle,cardboard drum Application:Active Pharmaceutical I

    Suzhou Health Chemicals Co., Ltd. is A Fine Chemicals Company, specializing in research, development, manufacture and distribute raw materials for pharmaceutical, healthcare, bioch

  •  Suzhou Health Chemicals Co., Ltd.

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    Business Type:Lab/Research institutions

    Tel:+86-512-58277800

    Address:No. 338, Jingang Avenue,

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  • Mycophenolate mofetil

  • Casno:

    128794-94-5

    Mycophenolate mofetil

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 0.0-0.0

    Superior quality, moderate price & quick delivery. Appearance:white powder Storage:stored in a cool, dry and ventilated place to provent sun and rain Package:25kg/drum, or as per your request. Application:Used for active pharmaceutical ingr

    Hangzhou Yunuo Chemical Co., Ltd. is located in Hangzhou City, China We are specialized in fine chemicals and basic chemical auxiliary materials, Organic compounds, rubber

  •  HANGZHOU YUNUO CHEMICAL CO.,LTD

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    Tel:0571-83715115

    Address:hangzhou

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Standards and Recommendations

PURITY: 99% (TLC: 30% METHANOL/METHYLENE CHLORIDE; Rf = 0.44)
SOLUBILITY: Soluble in: DMSO (25 mg/mL); or ETHANOL (25mg/mL, warm)

Specification

The Mycophenolate mofetil, with the CAS registry number 128794-94-5, is also known as . It belongs to the product categories of Pharmaceutical Material and Intermeidates; Active Pharmaceutical Ingredients; Immunosuppressant; Aromatics Compounds; Aromatics; Inhibitors; Intermediates & Fine Chemicals; Pharmaceuticals. This chemical's molecular formula is C23H31NO7 and molecular weight is 433.49474. Its IUPAC name is called 2-morpholin-4-ylethyl (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate. This chemical's classification codes are Immunologic Factors; Immunomodulator; Immunosuppressive agents. Mycophenolate mofetil (MMF)(CellCept by Roche) is a immunosuppressant and prodrug of mycophenolic acid, used extensively in transplant medicine. It is a useful alternative to azathioprine when Aza toxicity precludes use. When you are using this chemical, please be cautious about it. It is harmful if swallowed. You should not breathe its dust.

Physical properties of Mycophenolate mofetil: (1)ACD/LogP: 3.15; (2)ACD/LogD (pH 5.5): 2.14; (3)ACD/LogD (pH 7.4): 3.1; (4)ACD/BCF (pH 5.5): 14.34; (5)ACD/BCF (pH 7.4): 129.6; (6)ACD/KOC (pH 5.5): 121.3; (7)ACD/KOC (pH 7.4): 1096.21; (8)#H bond acceptors: 8; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 11; (11)Index of Refraction: 1.557; (12)Molar Refractivity: 114.22 cm3; (13)Molar Volume: 354.6 cm3; (14)Surface Tension: 48.4 dyne/cm; (15)Density: 1.222 g/cm3; (16)Flash Point: 339.4 °C; (17)Enthalpy of Vaporization: 97.61 kJ/mol; (18)Boiling Point: 637.6 °C at 760 mmHg; (19)Vapour Pressure: 7.51E-17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCN3CCOCC3)OC
(2)Isomeric SMILES: CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(\C)/CCC(=O)OCCN3CCOCC3)OC
(3)InChI: InChI=1S/C23H31NO7/c1-15(5-7-19(25)30-13-10-24-8-11-29-12-9-24)4-6-17-21(26)20-18(14-31-23(20)27)16(2)22(17)28-3/h4,26H,5-14H2,1-3H3/b15-4+
(4)InChIKey: RTGDFNSFWBGLEC-SYZQJQIISA-N

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