4-Methyldibenzo[b,d]thiophene

Basic Information

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CAS Number

7372-88-5

Molecular Formula

C13H10S

Molecular Weight

198.29 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

64-68 °C

Boiling Point

298 °C

Density

1.213±0.06 g/cm3 (20 ºC 760 Torr),

Flash Point

122.6±5.5 ºC,

Solubility

Insuluble (2.4E-4 g/L) (25 ºC),

Refractive Index

1.6170 (estimate)

SMILES

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CC1=C2C(=CC=C1)C3=CC=CC=C3S2

InChI

InChI=1S/C13H10S/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8H,1H3

InChIKey

NICUQYHIOMMFGV-UHFFFAOYSA-N

LogP

4.362920000000002

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

213

Synonyms & References

English

BIDD:GT0744
CHEBI:173983
Dibenzothiophene, 4-methyl-
SCHEMBL731864
7372-88-5
E85522
6-methyl-8-thiatricyclo[7.4.0.0^{2,7}]trideca-1(13),2,4,6,9,11-hexaene
MFCD00216258
A866037
InChI=1/C13H10S/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8H,1H
4-METHYLDIBENZOTHIOPHENE
4-methyl-dibenzothiophene
FT-0694726
4-Methyldibenzothiophene, 96%
AS-59813
AKOS015889080
4-Methyldibenzo[b,d]thiophene
Dibenzothiophene, 4-methyl-;
DTXSID00880809
dibenzo[b,d]thiophene, 4-methyl-
6-METHYL-8-THIATRICYCLO[7.4.0.0(2),?]TRIDECA-1(9),2(7),3,5,10,12-HEXAENE
NICUQYHIOMMFGV-UHFFFAOYSA-N
NS00076520
4-Methyldibenzo[b,d]thiophene #
4-methyldibenzo[b]thiophene
Dibenzothiophene, 1-methyl-
Dibenzothiophene,4-methyl-
4-Methyldibenzothiophene
4-methyl-DBT
4-methyldibenzothiophen
4-methyldibezothiophene

MDL Number

MFCD00216258

FAQ

What regulatory guidelines apply to 4-Methyldibenzo[b,d]thiophene (CAS: 7372-88-5)?

Regulatory guidelines for 4-Methyldibenzo[b,d]thiophene (CAS: 7372-88-5) include GHS classification for hazardous substances, REACH regulations for classification, labeling, and approval, as well as FDA and EPA requirements for safety and environmental protection. Manufacturers and users must comply with these regulations to ensure the safe handling and disposal of the compound.

Are there alternatives to 4-Methyldibenzo[b,d]thiophene in synthesis?

In synthesis, alternatives to 4-Methyldibenzo[b,d]thiophene include other thiophene derivatives such as 2-Methylthiophene, 2-Ethylthiophene, and 1,3-Dithiolane. These compounds can serve similar purposes and are often chosen based on availability, cost, and specific reaction requirements.

What is the market or research trend for 4-Methyldibenzo[b,d]thiophene?

The market for 4-Methyldibenzo[b,d]thiophene (CAS: 7372-88-5) is influenced by increasing demand in the pharmaceutical, polymer, and electronic industries. Research trends are focused on exploring its applications in drug synthesis, as well as its use in developing new materials with specific properties. The compound's unique structure and chemical properties make it a valuable asset in these fields.

How should waste containing 4-Methyldibenzo[b,d]thiophene (CAS: 7372-88-5) be handled?

Waste containing 4-Methyldibenzo[b,d]thiophene (CAS: 7372-88-5) should be collected in appropriate containers and stored separately to prevent contamination. Proper incineration or professional waste disposal services should be used to ensure safe disposal. Environmental protection precautions include minimizing exposure to air and water during handling and disposal to avoid environmental hazards.