(2-nitroethenyl)benzene

Basic Information

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CAS Number

102-96-5

Molecular Formula

C8H7NO2

Molecular Weight

149.15 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

203 ºC (acetone )

Boiling Point

120 ºC (1 Torr)

Flash Point

117.5±11.5 ºC,

Refractive Index

1.5320 (estimate)

SMILES

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C1=CC=C(C=C1)C=C[N+](=O)[O-]

InChI

InChI=1S/C8H7NO2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H/b7-6+

InChIKey

PIAOLBVUVDXHHL-VOTSOKGWSA-N

LogP

log Kow = 2.11

Complexity

154

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

Stability

Stable. Combustible. Incompatible with strong oxidizing agents, strong bases. May be sensitive to prolonged exposure to air.

Synonyms & References

English

NCGC00254585-01
AI3-16827
BRN 2042432
2'-Nitrostyrene
trans-beta-Nitrostyrene
NITROSTYRENE, TRANS-BETA-
omega-Nitrostyrene
DTXSID6033247
((E)-2-nitro-vinyl)-benzene
NSC9809
BDBM50504465
[(E)-2-Nitroethenyl]benzene
Tox21_300677
.BETA.-NITROSTYRENE, (E)-
(E)-1-NITRO-2-PHENYLETHYLENE
CAS-5153-67-3
Benzene, (2-nitroethenyl)-
AMY12555
2-PHENYL-1-NITROETHENE
NSC 9809
trans-4-(2-Nitroethenyl)benzene
.omega.-Nitrostyrene
MFCD00007402
.beta.-Nitrosytrene
[(E)-2-nitrovinyl]benzene
AKOS005207248
NS8
EN300-342539
Trans Beta Nitrostyrene
NSC-9809
beta-Nitrosytrene

MDL Number

MFCD00007402

FAQ

What is (2-nitroethenyl)benzene (CAS: 102-96-5)?

(2-nitroethenyl)benzene, also known as 2-nitro-1-benzeneethanol, is an organic compound with the CAS number 102-96-5. It is a colorless liquid with a distinct odor and is used in various industrial and research applications. It has a molecular formula of C9H9NO2 and a molecular weight of 165.16 g/mol. The compound is characterized by its aromatic structure and nitro group, which influence its chemical reactivity and physical properties.

What are the main uses of (2-nitroethenyl)benzene (CAS: 102-96-5)?

(2-nitroethenyl)benzene is primarily used in the synthesis of various organic compounds, particularly in the production of pharmaceuticals and dyes. It serves as a key intermediate in the manufacturing of nitroaromatic compounds and is also utilized in the development of new materials and research applications. Due to its reactivity, it is less commonly used directly in end products but plays a crucial role in the industrial synthesis process.

Is (2-nitroethenyl)benzene (CAS: 102-96-5) safe?

Safety considerations for (2-nitroethenyl)benzene (CAS: 102-96-5) should be approached with caution due to its chemical reactivity. It is classified as a flammable liquid and requires proper storage and handling to prevent fires and explosions. Protective measures include the use of appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats. It is important to avoid contact with eyes, skin, and clothing, and to ensure proper ventilation during use. Safe handling practices and adherence to safety guidelines are crucial to minimize risks.

How should (2-nitroethenyl)benzene (CAS: 102-96-5) be stored?

(2-nitroethenyl)benzene (CAS: 102-96-5) should be stored in a cool, dry, and well-ventilated area away from heat sources, open flames, and oxidizing agents. It should be kept in a tightly sealed container to prevent evaporation and contamination. Storage temperature should not exceed 25°C (77°F), and exposure to light should be minimized to avoid degradation. Adequate ventilation is essential to prevent the build-up of flammable vapors. It is recommended to store it in a fire-resistant cabinet or a designated chemical storage area for flammable liquids.