7H-Benzo[de]anthracen-7-one

Basic Information

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CAS Number

82-05-3

Molecular Formula

C17H10O

Molecular Weight

230.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

172.0 to 176.0 deg-C

Boiling Point

436.2°C at 760 mmHg

Density

1.0929 (rough estimate)

Flash Point

196.1 °C

Refractive Index

1.5000 (estimate)

SMILES

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C1=CC=C2C(=C1)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H

InChIKey

HUKPVYBUJRAUAG-UHFFFAOYSA-N

LogP

4.051200000000002

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

348

Safety Information

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Hazard Statement

H316 Causes mild skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Stability

Stable. Incompatible with strong oxidizing agents.

Toxicity

LD50 in albino rabbits: >3 g/kg dermally; LD50 in rats, mice (g/kg): 1.5, 0.29 i.p. (Singh)

Synonyms & References

English

KBio3_002719
1,9-Benzanthrone
MLS002207268
benzo[a]phenalen-7-one;7H-Benzo[de]anthracen-7-one
FT-0621414
NSC-631641
7H-Benz(de)anthracen-7-one
Benzoanthrone
SPBio_000812
NSC5189
STK662686
A840240
WLN: L C6666 1A Q IVJ
Q2075398
MS-Benzanthrone
NCGC00095343-02
Naphthanthrone (VAN)
7H-benzo[de]anthracen-7-one
LP5P3RR8QN
UNII-LP5P3RR8QN
NSC 631641
7H-Benz[de]anthracene-7-one
AS-56358
Spectrum3_001680
CS-0070954
7H-Benz[de]anthracen-7-one
NCGC00178030-01
BENZANTHRONE [MI]
82-05-3
NSC-5189
CCG-38994

MDL Number

MFCD00003585

FAQ

What is 7H-Benzo[de]anthracen-7-one (CAS: 82-05-3)?

7H-Benzo[de]anthracen-7-one is a polycyclic aromatic hydrocarbon with the CAS number 82-05-3. It has a molecular formula of C20H12O and is characterized by its complex molecular structure. This compound is often used in research for studying aromatic compounds and their interactions.

What are the main uses of 7H-Benzo[de]anthracen-7-one (CAS: 82-05-3)?

7H-Benzo[de]anthracen-7-one is primarily used in research and analytical chemistry. It serves as a valuable reagent in the synthesis of other compounds and is also used for studying the properties of polycyclic aromatic hydrocarbons. Additionally, it is sometimes employed in the development of certain pharmaceuticals.

Is 7H-Benzo[de]anthracen-7-one (CAS: 82-05-3) safe?

7H-Benzo[de]anthracen-7-one is generally considered safe for use in controlled laboratory settings under proper handling and storage conditions. However, it is important to follow safety guidelines, including wearing protective gear such as gloves and goggles, and ensuring proper ventilation. Direct contact with skin or ingestion can be hazardous.

How should 7H-Benzo[de]anthracen-7-one (CAS: 82-05-3) be stored?

7H-Benzo[de]anthracen-7-one should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep it in a tightly sealed container to prevent degradation. The compound should be stored at room temperature (15-25°C) and protected from humidity and light exposure to maintain its stability and purity.