Benzo(b)naphtho(2,1-d)thiophene, 3-methyl- (CHEM115690)
| Record Information | |||||||||
|---|---|---|---|---|---|---|---|---|---|
| Version | 1.0 | ||||||||
| Creation Date | 2026-04-06 02:52:27 UTC | ||||||||
| Update Date | 2026-04-17 17:16:08 UTC | ||||||||
| Accession Number | CHEM115690 | ||||||||
| Identification | |||||||||
| Common Name | Benzo(b)naphtho(2,1-d)thiophene, 3-methyl- | ||||||||
| Class | Small Molecule | ||||||||
| Description | Benzo(b)naphtho(2,1-d)thiophene, 3-methyl- belongs to the naphthothiophenes, a subclass of naphthalenes within the organic compounds. It is a member of the benzenoids superclass with the chemical formula C17H12S and an average molecular weight of 248.34 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C17H12S | ||||||||
| Average Molecular Mass | 248.340 g/mol | ||||||||
| Monoisotopic Mass | 248.066 g/mol | ||||||||
| CAS Registry Number | 4567-45-7 | ||||||||
| IUPAC Name | 3-Methylbenzo[b]naphtho[2,1-d]thiophene | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC1=CC2=C(C=C1)C1=C(C=C2)C2=CC=CC=C2S1 | ||||||||
| InChI Identifier | InChI=1S/C17H12S/c1-11-6-8-13-12(10-11)7-9-15-14-4-2-3-5-16(14)18-17(13)15/h2-10H,1H3 | ||||||||
| InChI Key | JESYLDJZJBANHW-UHFFFAOYSA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
| ||||||||
| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
| ||||||||
| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
| Not Available | |||||||||
| External Links | |||||||||
| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
