3-Methylindole structure
|
Common Name | 3-Methylindole | ||
|---|---|---|---|---|
| CAS Number | 83-34-1 | Molecular Weight | 131.17 | |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 265.1±9.0 °C at 760 mmHg | |
| Molecular Formula | C9H9N | Melting Point | 92-97 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 112.5±11.3 °C | |
| Symbol |
GHS07, GHS09 |
Signal Word | Warning | |
Use of 3-MethylindoleSkatole is produced by intestinal bacteria, regulates intestinal epithelial cellular functions through activating aryl hydrocarbon receptors and p38[1]. |
| Name | skatole |
|---|---|
| Synonym | More Synonyms |
| Description | Skatole is produced by intestinal bacteria, regulates intestinal epithelial cellular functions through activating aryl hydrocarbon receptors and p38[1]. |
|---|---|
| Related Catalog | |
| Target |
p38 Aryl hydrocarbon receptor |
| References |
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 265.1±9.0 °C at 760 mmHg |
| Melting Point | 92-97 °C(lit.) |
| Molecular Formula | C9H9N |
| Molecular Weight | 131.17 |
| Flash Point | 112.5±11.3 °C |
| Exact Mass | 131.073502 |
| PSA | 15.79000 |
| LogP | 2.60 |
| Vapour Pressure | 0.0±0.5 mmHg at 25°C |
| Index of Refraction | 1.655 |
| InChIKey | ZFRKQXVRDFCRJG-UHFFFAOYSA-N |
| SMILES | Cc1c[nH]c2ccccc12 |
| Stability | Stable, but light-sensistive. Stench! Incompatible with strong oxidizing agents, strong acids, acid ahydrides, acid chlorides. Combustible. |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
|
| Symbol |
GHS07, GHS09 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335-H411 |
| Precautionary Statements | P261-P273-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | UN3077 - class 9 - PG 3 - DOT/IATA UN3335 - Environmentally hazardous substances, solid, n.o.s., HI: all (not BR) |
| WGK Germany | 2 |
| RTECS | NM0350000 |
| HS Code | 2933990090 |
| Precursor 9 | |
|---|---|
| DownStream 10 | |
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Olfactometry Profiles and Quantitation of Volatile Sulfur Compounds of Swiss Tilsit Cheeses.
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Fluorescence of tryptophan in designed hairpin and Trp-cage miniproteins: measurements of fluorescence yields and calculations by quantum mechanical molecular dynamics simulations.
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Investigation of the sunscreen octocrylene's interaction with amino acid analogs in the presence of UV radiation.
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Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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|
Name: Primary qHTS assay for inhibitors of alpha-synuclein gene (SNCA) expression
Source: NCGC
External Id: SNCA-p-activity-luciferase
|
|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
|
|
Name: Cytochrome P450 Family 1 Subfamily A Member 2 (CYP1A2) small molecule antagonists: lu...
Source: 824
External Id: CYP273
|
|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
|
|
Name: p53 small molecule agonists, cell-based qHTS assay: qHTS cell viability counter scree...
Source: 824
Target: N/A
External Id: P53600
|
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Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: qHTS ce...
Source: 824
Target: N/A
External Id: P53MS958
|
|
Name: p53 small molecule agonists, cell-based qHTS assay with rat liver microsomes: Summary
Source: 824
External Id: P53MS482
|
|
Name: p53 small molecule agonists, cell-based qHTS assay with human liver microsomes
Source: 824
Target: tumor suppressor p53 [Homo sapiens]
External Id: P53MS233
|
| SKATOLE(RG) |
| 3-MI |
| MFCD00005627 |
| 3-Methyl-1H-indole |
| SKATOL |
| EINECS 201-471-7 |
| 3-Methylindole |
| SCATOLE |
| β-Methylindole |
| T56 BMJ D1 |
| Skatole |
| b-Methylindole |
| SKETOLE |
| 3-Metlylindole |
| 3-methyl-indole |
| scatol |
| FEMA 3019 |
| 3-Methyl-1H-indazole |