|
|
|
Substance Name: Dibenzothiophene [USAN]
RN: 132-65-0
UNII: Z3D4AJ1R48
InChIKey: IYYZUPMFVPLQIF-UHFFFAOYSA-N
Classification Code
- Keratolytic
Molecular Formula
- C12-H8-S
Molecular Weight
- 184.261
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
Names and Synonyms
Name of Substance
- Dibenzothiophene
- Dibenzothiophene [USAN]
- Diphenylene sulfide
Synonyms
- (1,1'-Biphenyl)-2,2'-diyl sulfide
- 2,2'-Biphenylylene sulfide
- 9-Thiafluorene
- AI3-00043
- alpha-Thiafluorene
- CCRIS 5307
- Dibenzo(b,d)thiophene
- Dibenzothiophene
- Diphenylene sulfide
- EINECS 205-072-9
- HSDB 7409
- NSC 2843
- UNII-Z3D4AJ1R48
Systematic Name
- Dibenzothiophene
Registry Numbers
CAS Registry Number
- 132-65-0
FDA UNII
- Z3D4AJ1R48
System Generated Number
- 0000132650
Structure Descriptors
InChI
InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8HInChIKey
IYYZUPMFVPLQIF-UHFFFAOYSA-NSmiles
c1ccc2c(c1)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD | intraperitoneal | > 500mg/kg (500mg/kg) | "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. Vol. 4, Pg. 378, 1952. | |
| mouse | LD50 | oral | 470mg/kg (470mg/kg) | BEHAVIORAL: GENERAL ANESTHETIC BEHAVIORAL: COMA | Fundamental and Applied Toxicology. Vol. 12, Pg. 787, 1989. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 97 | deg C | EXP | |
| Boiling Point | 332.5 | deg C | EXP | |
| log P (octanol-water) | 4.38 | (none) | EXP | |
| Water Solubility | 1.47 | mg/L | 25 | EXP |
| Henry's Law Constant | 3.38E-05 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 8.10E-12 | cm3/molecule-sec | 24 | EXP |
Physical property data is provided to ChemIDplus by SRC, Inc.