4'-Propoxy-4-biphenylcarbonitrile

Basic Information

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CAS Number

52709-86-1

Molecular Formula

C16H15NO

Molecular Weight

226.32 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Melting Point

71.0 to 75.0 deg-C

Boiling Point

393.1°C at 760 mmHg

Density

1.0479 (rough estimate)

Refractive Index

1.6000 (estimate)

SMILES

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CCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H15NO/c1-2-11-18-16-9-7-15(8-10-16)14-5-3-13(12-17)4-6-14/h3-10H,2,11H2,1H3

InChIKey

RZCQJZFWJZHMPK-UHFFFAOYSA-N

LogP

4.450820000000004

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

277

Safety Information

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GHS Hazard Pictograms

H301

H315

H319

H335

Hazard Statement

H301 Toxic if swallowed
Acute toxicity, oral

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-Propoxy-4'-biphenylcarbonitrile
MFCD00183206
C2911
4'-Propoxy-4-biphenylcarbonitrile
3-Amino-1-N-methyl-azetidinedihydrochloride
4-Cyano-4'-propoxybiphenyl
D86560
4 inverted exclamation mark -Propoxy-[1,1 inverted exclamation mark -biphenyl]-4-carbonitrile
SP3QT6RQ3T
4'-Propoxy-(1,1'-biphenyl)-4-carbonitrile
NS00032560
SY057242
DTXSID5068788
4-cyano-4'-n-propoxybiphenyl
4'-PROPOXY-BIPHENYL-4-CARBONITRILE
RZCQJZFWJZHMPK-UHFFFAOYSA-
Oprea1_298863
DS-15531
[1,1'-Biphenyl]-4-carbonitrile, 4'-propoxy-
4-Propoxy-[1,1'-biphenyl]-4'-carbonitrile
AMY25188
4'-Propoxy(1,1'-biphenyl)-4-carbonitrile
FT-0640098
4-Cyano-4'-propyloxybiphenyl
4'-Propoxy[1,1'-biphenyl]-4-carbonitrile
Cambridge id 5305853
4-Propoxycyanodiphenyl
RZCQJZFWJZHMPK-UHFFFAOYSA-N
CS-W012847
AKOS001585033
InChI=1/C16H15NO/c1-2-11-18-16-9-7-15(8-10-16)14-5-3-13(12-17)4-6-14/h3-10H,2,11H2,1H3

MDL Number

MFCD00183206

Customs Code

2926909090

FAQ

What is 4'-Propoxy-4-biphenylcarbonitrile (CAS: 52709-86-1)?

4'-Propoxy-4-biphenylcarbonitrile is an organic compound with a molecular formula of C18H13CN. It is a colorless to white solid with a distinctive odor. This substance is used in various applications including pharmaceuticals, dyes, and as a precursor in chemical synthesis.

What are the main uses of 4'-Propoxy-4-biphenylcarbonitrile (CAS: 52709-86-1)?

4'-Propoxy-4-biphenylcarbonitrile is primarily used in the pharmaceutical industry for the synthesis of drugs. It is also utilized in the production of dyes and as a precursor in chemical synthesis for various organic compounds.

Is 4'-Propoxy-4-biphenylcarbonitrile (CAS: 52709-86-1) safe?

4'-Propoxy-4-biphenylcarbonitrile is generally safe when handled with appropriate precautions. It is important to follow safety guidelines, including wearing appropriate personal protective equipment, and to store it in a cool, dry, and well-ventilated area away from direct sunlight and ignition sources.

How should 4'-Propoxy-4-biphenylcarbonitrile (CAS: 52709-86-1) be stored?

4'-Propoxy-4-biphenylcarbonitrile should be stored in a cool, dry, and well-ventilated area. It should be kept away from direct sunlight and heat sources. It is recommended to store it in a sealed container to prevent moisture absorption and degradation. Maintain a temperature between 15-25°C and avoid exposure to high humidity environments.