2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile

Basic Information

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CAS Number

950596-58-4

Molecular Formula

C13H18N2O4

Molecular Weight

255.31 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

445.5±45.0°C at 760 mmHg

SMILES

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COCCOC1=C(C=C(C(=C1)C#N)N)OCCOC

InChI

InChI=1S/C13H18N2O4/c1-16-3-5-18-12-7-10(9-14)11(15)8-13(12)19-6-4-17-2/h7-8H,3-6,15H2,1-2H3

InChIKey

XCXKYIJVCWFCLF-UHFFFAOYSA-N

LogP

1.62762

Topological Polar Surface Area

62.94 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

292

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Synonyms & References

English

2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile
2-Amino-4,5-bis-(2-methoxy-ethoxy)-benzonitrile
4-5-bis(2-methoxyethoxy)-2-aminobenzonitrile
Carboprost
BENZONITRILE, 2-AMINO-4,5-BIS(2-METHOXYETHOXY)-
XCXKYIJVCWFCLF-UHFFFAOYSA-N
AMX10163
AB0043788
AX8237198
Z1739
AM20090608
ST24039914
596A584
2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile (ACI)
950596-58-4
CS-0150174
Benzonitrile, 2-amino-4,5-bis(2-methoxyethoxy)-; 2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile
J-514268
MFCD16619377
SY028057
F19646
CM4L52HJC6
DTXSID70635828
DS-18424
2-AMINO-4,5-BIS(2-METHOXYETHOXY)BENZONITRILE
AKOS015895490
SCHEMBL482053

MDL Number

MFCD16619377

FAQ

What is 2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile (CAS: 950596-58-4)?

2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile is an organic compound with the CAS number 950596-58-4. It has a molecular formula of C14H26N2O4 and is used in various applications due to its chemical properties.

What are the main uses of 2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile (CAS: 950596-58-4)?

2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile is primarily used in the pharmaceutical industry as an intermediate for the synthesis of drugs. It is also utilized in research and development for its unique chemical properties.

Is 2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile (CAS: 950596-58-4) safe?

2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile is generally considered safe when handled with proper precautions. It is important to follow safety guidelines, such as wearing appropriate protective equipment and ensuring adequate ventilation.

How should 2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile (CAS: 950596-58-4) be stored?

2-Amino-4,5-bis(2-methoxyethoxy)benzonitrile should be stored in a cool, dry place, away from direct sunlight and sources of heat. It should be kept in a tightly closed container and protected from moisture and air exposure to maintain its stability.