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[1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methylis a complex organic compound that features a biphenyl carboxylic acid group and a substituted amine group. [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methylis characterized by a 4-carboxylic acid moiety attached to a 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methylstructure. The presence of a biphenyl group and a carboxylic acid functionality makes this compound significant in the realms of organic synthesis and medicinal chemistry. The substituted amine group also indicates potential pharmacological properties, suggesting its use in drug development and biological research.

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  • [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methyl-

    Cas No: 787583-71-5

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  • 787583-71-5 Structure
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    1. Product Name: [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-diMethylethyl]aMino]-2-hydroxypropoxy]ethyl]-3-Methyl-
    2. Synonyms: [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-diMethylethyl]aMino]-2-hydroxypropoxy]ethyl]-3-Methyl-;Encaleret;UNFHDRVFEQPUEL-DENIHFKCSA-N
    3. CAS NO:787583-71-5
    4. Molecular Formula: C29H33ClFNO4
    5. Molecular Weight: 514.0280232
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 787583-71-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-diMethylethyl]aMino]-2-hydroxypropoxy]ethyl]-3-Methyl-(CAS DataBase Reference)
    10. NIST Chemistry Reference: [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-diMethylethyl]aMino]-2-hydroxypropoxy]ethyl]-3-Methyl-(787583-71-5)
    11. EPA Substance Registry System: [1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-diMethylethyl]aMino]-2-hydroxypropoxy]ethyl]-3-Methyl-(787583-71-5)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 787583-71-5(Hazardous Substances Data)

787583-71-5 Usage

Uses

Used in Pharmaceutical Industry:
[1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methylis used as a potential pharmaceutical agent for its possible pharmacological activity due to the presence of a substituted amine group, which may contribute to its interaction with biological targets.
Used in Organic Synthesis:
In the field of organic synthesis, this compound serves as a building block or intermediate for the synthesis of more complex organic molecules, leveraging its biphenyl carboxylic acid group and unique amine substitution for the creation of novel chemical entities.
Used in Medicinal Chemistry:
[1,1'-Biphenyl]-4-carboxylic acid, 2'-[(1R)-1-[(2R)-3-[[2-(4-chloro-3-fluorophenyl)-1,1-dimethylethyl]amino]-2-hydroxypropoxy]ethyl]-3-methylis utilized in medicinal chemistry for the development of new drugs, given its structural complexity and the potential for it to be optimized for specific therapeutic targets.

Check Digit Verification of cas no

The CAS Registry Mumber 787583-71-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 7,8,7,5,8 and 3 respectively; the second part has 2 digits, 7 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 787583-71:
(8*7)+(7*8)+(6*7)+(5*5)+(4*8)+(3*3)+(2*7)+(1*1)=235
235 % 10 = 5
So 787583-71-5 is a valid CAS Registry Number.

787583-71-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-[2-[(1R)-1-[(2R)-3-[[1-(4-chloro-3-fluorophenyl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]ethyl]phenyl]-2-methylbenzoic acid

1.2 Other means of identification

Product number -
Other names JTT-305

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:787583-71-5 SDS

787583-71-5Downstream Products

787583-71-5Relevant articles and documents

Discovery of a potent and short-acting oral calcilytic with a pulsatile secretion of parathyroid hormone

Shinagawa, Yuko,Inoue, Teruhiko,Katsushima, Takeo,Kiguchi, Toshihiro,Ikenogami, Taku,Ogawa, Naoki,Fukuda, Kenji,Hirata, Kazuyuki,Harada, Kazuhito,Takagi, Masaki,Nakagawa, Takashi,Kimura, Shuichi,Matsuo, Yushi,Maekawa, Mariko,Hayashi, Mikio,Soejima, Yuki,Takahashi, Mitsuru,Shindo, Masanori,Hashimoto, Hiromasa

, p. 238 - 242 (2011/04/26)

Short-acting oral calcilytics, calcium-sensing receptor (CaSR) antagonists, have been considered as alternatives for parathyroid hormone (PTH), an injectable bone anabolic drug used in the treatment of osteoporosis. Previously, we identified aminopropandi

PRODUCTION METHOD OF CARBOXYLIC ACID COMPOUND

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Page/Page column 13, (2010/12/29)

The present invention provides the production method of carboxylic acid compound, as shown in Scheme I.

CaSR antagonist

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Page/Page column 42, (2010/02/10)

A compound represented by the following formula (1), a pharmaceutically acceptable salt thereof or an optically active form thereof: wherein each symbol is as defined in the specification. A compound having a calcium-sensing receptor antagonistic action, a pharmaceutical composition comprising the compound, particularly a calcium receptor antagonist and a therapeutic drug for osteoporosis are provided.

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