Anidulafungin Impurity 3

Basic Information

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CAS Number

158938-08-0

Molecular Formula

C24H24O3

Molecular Weight

360.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

557.9±43.0°C at 760 mmHg

SMILES

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CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H24O3/c1-2-3-4-17-27-23-15-13-21(14-16-23)19-7-5-18(6-8-19)20-9-11-22(12-10-20)24(25)26/h5-16H,2-4,17H2,1H3,(H,25,26)

InChIKey

APIUMVXKBCYBSC-UHFFFAOYSA-N

LogP

6.287800000000005

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

425

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

4''-(Pentyloxy)-[1,1':4',1''-terphenyl]-4-carboxylic acid
AM20090712
4'-(n-pentyloxy)-[1,1':4',1'-terphenyl]-4-carboxylic acid
CS-0152124
C73005
MFCD17019206
4''-n-pentoxy-[1,1':4',1'']-terphenyl-4-carboxylic acid
SCHEMBL3074389
158938-08-0
A883337
4''-n-pentoxy[1,1':4',1'']-terphenyl-4-carboxylic acid
APIUMVXKBCYBSC-UHFFFAOYSA-N
[1,1:4,1-Terphenyl]-4-carboxylic acid,4-(pentyloxy)-
AKOS015917919
DS-8022
C24H24O3
4-[4-(4-pentoxyphenyl)phenyl]benzoic Acid
4''-(Pentyloxy)-[1,1':4',1''-terphenyl]-4-carboxylicacid
BCP33293
[1,1':4',1''-Terphenyl]-4-carboxylic acid, 4''-(pentyloxy)-
4''-(pentyloxy)-[1,1':4',1''-Terphenyl]-4-carboxylic acid
4''-(Pentyloxy)-1,1':4',1''-terphenyl-4-carboxylic acid
4\'\'-(Pentyloxy)-1,1\':4\',1\'\'-terphenyl-4-carboxylic acid
4&quot
4-(4-pentenyl)-benzonitrile
4-(4''-pentyloxy-1,1':4',1''-terphenyl)-carboxylic acid
4''-(n-pentyloxy)-[1,1':4',1''-terphenyl]-4-carboxylic acid
4-(pent-4-en-1-yl)benzonitrile
4-(pent-4-enyl)benzonitrile
4''-n-pentoxy[1,1':4',1'']terphenyl-4-carboxylic acid
ACMC-20lzd5

MDL Number

MFCD17019206

FAQ

What regulatory guidelines apply to Anidulafungin Impurity 3 (CAS: 158938-08-0)?

Anidulafungin Impurity 3 (CAS: 158938-08-0) should comply with regulatory guidelines such as the REACH (Registration, Evaluation, Authorization, and Restriction of Chemicals) regulations in the European Union, FDA (Food and Drug Administration) guidelines in the United States, and EPA (Environmental Protection Agency) regulations. Additionally, it should adhere to GHS (Globally Harmonized System of Classification and Labeling of Chemicals) standards for hazard communication.

Are there alternatives to Anidulafungin Impurity 3 (CAS: 158938-08-0) in synthesis?

In the synthesis of anidulafungin, alternatives to Anidulafungin Impurity 3 can include using different impurity profiles or employing substitute reagents such as cyclopropylglycine ethyl ester or other analogous compounds. These alternatives can help in reducing impurities and improving product purity.

What is the market or research trend for Anidulafungin Impurity 3 (CAS: 158938-08-0)?

The market for Anidulafungin Impurity 3 (CAS: 158938-08-0) is closely tied to the research and development of anidulafungin as an antifungal medication. Recent trends indicate an increasing focus on reducing impurities in drug synthesis to improve drug efficacy and safety. Additionally, there is a growing emphasis on green chemistry and sustainable practices in pharmaceutical manufacturing.

How should waste containing Anidulafungin Impurity 3 (CAS: 158938-08-0) be handled?

Waste containing Anidulafungin Impurity 3 (CAS: 158938-08-0) should be collected in appropriate containers and stored in a secure location. Proper disposal methods may include incineration or professional waste disposal services. Environmental precautions should be taken to prevent contamination of water sources and soil. Compliance with local hazardous waste regulations is essential to ensure safe handling and disposal.