什么是5-Methylindole (CAS 614-96-0)？

5-Methylindole (CAS 614-96-0) 是一种化学品，CAS 登记号为 614-96-0。分子式: C9H9N. 摩尔质量: 131.17 g/mol. IUPAC: 5-methyl-1H-indole.

5-Methylindole (CAS 614-96-0) 的 CAS 号是多少？

5-Methylindole (CAS 614-96-0) 的 CAS 号为 614-96-0——化学文摘社 (CAS) 的唯一标识符。

5-Methylindole (CAS 614-96-0) 的分子式是什么？

分子式: C9H9N. 摩尔质量: 131.17 g/mol. logP (XLogP3): 2.7. PSA: 15.8 Å².

5-Methylindole (CAS 614-96-0) 有哪些 GHS 危害？

根据 GHS 分类，5-Methylindole (CAS 614-96-0) 须标注以下危险说明： H315 (造成皮肤刺激), H319 (造成严重眼刺激), H335 (可引起呼吸道刺激).

在哪里可以购买5-Methylindole (CAS 614-96-0)？

5-Methylindole (CAS 614-96-0) 在我们的商店有售。查看产品：https://molgod.org/sds-cards/5-methylindole-cas-614-96-0-beijing-tong-guang/

5-Methylindole (CAS 614-96-0) 的化学数据来自哪里？

5-Methylindole (CAS 614-96-0) 的化学数据来自权威来源：PubChem (NIH), ChEMBL (EBI)。 PubChem CID: 11978. 符合 CLP 法规（EC 1272/2008），依据 CC-BY 4.0 许可提供。

5-Methylindole (CAS 614-96-0)

Name: 5-Methylindole (CAS 614-96-0) (CAS 614-96-0) ——完整化学数据集
Creator: MolGod
License: https://creativecommons.org/licenses/by/4.0/

5-Methylindole

CAS 614-96-0 · C₉H₉N · MW 131.17 g/mol

关于 5-Methylindole (CAS 614-96-0)

5-Methylindole (CAS 614-96-0) 是一种化学品，登记号为 CAS 614-96-0，分子式为 C₉H₉N，摩尔质量为 131.17 g/mol。

在理化性质方面，分配系数 logP = 2.7 (正值，亲脂性化合物)，极性表面积 PSA = 15.8 Å²，1 个氢键供体和 0 个氢键受体。这些参数对于评估生物利用度以及与生物分子的相互作用至关重要。

该化合物的化学数据来自 PubChem（NIH NLM NCBI），全球最大的化学数据库之一。所有信息均自动更新，并附有符合 CLP 法规（EC 1272/2008）的 GHS 危险说明翻译。上方的小部件可用于教育、研究和商业用途。

理化性质

Wzór sumaryczny	C₉H₉N
Masa molowa	131.17 g/mol
IUPAC	5-methyl-1H-indole
SMILES	`CC1=CC2=C(C=C1)NC=C2`
InChIKey	`YPKBCLZFIYBSHK-UHFFFAOYSA-N`
logP (XLogP3)	2.7
PSA	15.8 Å²
HBD / HBA	1 / 0
PubChem CID	CID 11978 ↗

GHS 安全

Sygnał: Uwaga

GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

科学文献

Related literature

20 artykułów · 11 open access · Źródła: PubMed, OpenAlex, Semantic Scholar

📈 Timeline publikacji (20 artykułów)

Wysokość słupka = liczba artykułów w roku. Hover dla szczegółów.

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5-Methylindole kills various bacterial pathogens and potentiates aminoglycoside against methicillin-resistant Staphylococcus aureus.

Li Z, Sun F, Fu X et al. (2022) · PeerJ

Cytowania: 4Open AccessDOI ↗PubMed ↗PDF ↗

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5-Methylindole Potentiates Aminoglycoside Against Gram-Positive Bacteria Including Staphylococcus aureus Persisters Under Hypoionic Conditions.

Sun F, Bian M, Li Z et al. (2020) · Frontiers in cellular and infection microbiology

Cytowania: 29Open AccessDOI ↗PubMed ↗PDF ↗

Mass analyzed threshold ionization spectroscopy of 5-methylindole and 3-methylindole cations and the methyl substitution effect.

Lin JL, Zhang S, Tzeng WB (2004) · The Journal of chemical physics

Cytowania: 8$ PaywallDOI ↗PubMed ↗

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Antibiofilm and Antivirulence Properties of Indoles Against Serratia marcescens.

Sethupathy S, Sathiyamoorthi E, Kim YG et al. (2020) · Frontiers in microbiology

Cytowania: 60Open AccessDOI ↗PubMed ↗PDF ↗

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Suppression of Fluconazole Resistant Candida albicans Biofilm Formation and Filamentation by Methylindole Derivatives

Jin-Hyung Lee, Yong-Guy Kim, Vivek Kumar Gupta et al. (2018) · Frontiers in Microbiology

Cytowania: 39Open AccessDOI ↗PDF ↗

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Crystal structure of 1-toluidino-2,3-diphenyl-5-methylindole, C28H24N2

Aulwurm U. R., Knoch F., Kisch H. (1997) · Zeitschrift für Kristallographie - New Crystal Structures

Open AccessDOI ↗PDF ↗

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Crystal structure of 1-toluidino-2,3-diphenyl-5-methylindole, C28H24N2

Aulwurm U. R., Knoch F., Kisch H. (1997) · Zeitschrift für Kristallographie - New Crystal Structures

Open AccessDOI ↗PDF ↗

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Crystal structure of 1-anilino-2,3-diphenyl-5-methylindole, C27H22N2

Aulwurm U. R., Knoch F., Kisch H. (1997) · Zeitschrift für Kristallographie - New Crystal Structures

Open AccessDOI ↗PDF ↗

1-P-CHLOROBENZYL-5-METHYLINDOLE-3-ACETIC ACID. SOME 2-SUBSTITUTED DERIVATIVES.

WALTON E, STAMMER CH, NUTT RF et al. (1965) · Journal of medicinal chemistry

$ PaywallDOI ↗PubMed ↗

Some analogs of 1-p-chlorobenzyl-5-methylindole-3-acetic acid.

Walton E, Jenkins SR, Nutt RF et al. (1968) · Journal of medicinal chemistry

$ PaywallDOI ↗PubMed ↗

Supplemental Information 5: 5-Methylindole specifically potentiates aminoglycosides.

$ PaywallDOI ↗

Table 1: MICs of 5-methylindole examined in this study.

$ PaywallDOI ↗

Figure 3: 5-Methylindole exhibited bactericidal activity against antibiotic-resistant/tolerant bacteria.

$ PaywallDOI ↗

Figure 1: 5-Methylindole exhibited bactericidal activity against Gram-positive bacteria in stationary-phase.

$ PaywallDOI ↗

Benzoannelation of 2-methylindole via 1-N-carboxy-2-methylindole dianion: A direct regiospecific route to substituted and annelated carbazoles

U.K.Syam Kumar, Pranab K. Patra, H. Ila et al. (1998) · Tetrahedron Letters

Cytowania: 20$ PaywallDOI ↗

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Cellulose/pectin-based materials incorporating Laponite-indole derivative hybrid for oral administration and controlled delivery of the neuroprotective drug.

Bravo I, Viejo L, de Los Ríos C et al. (2023) · International journal of biological macromolecules

Open AccessDOI ↗PubMed ↗PDF ↗

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Generation of new protein kinase inhibitors utilizing cytochrome p450 mutant enzymes for indigoid synthesis.

Guengerich FP, Sorrells JL, Schmitt S et al. (2004) · Journal of medicinal chemistry

Open AccessDOI ↗PubMed ↗PDF ↗

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Utilization of indole analogs by carrot and tobacco cell tryptophan synthase in vivo and in vitro.

Widholm JM (1981) · Plant physiology

Open AccessDOI ↗PubMed ↗PDF ↗

Biotransformation of indole and its derivatives by a newly isolated Enterobacter sp. M9Z.

Qu Y, Zhang Z, Ma Q et al. (2015) · Applied biochemistry and biotechnology

$ PaywallDOI ↗PubMed ↗

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NMR studies of the mode of binding of corepressors and inducers to Escherichia coli trp repressor.

Ramesh V, Syed SE, Frederick RO et al. (1996) · European journal of biochemistry

Open AccessDOI ↗PubMed ↗PDF ↗

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

数据来源

📊 PubChem CID 11978 — NIH
🔬 NIST WebBook — spektroskopia
🌐 Wikidata
💊 ChEMBL — bioaktywność

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