2-Methyl-5-nitroindole - CAS 7570-47-0
Catalog: |
BB035381 |
Product Name: |
2-Methyl-5-nitroindole |
CAS: |
7570-47-0 |
Synonyms: |
2-methyl-5-nitro-1H-indole |
IUPAC Name: | 2-methyl-5-nitro-1H-indole |
Description: | 2-Methyl-5-nitroindole (CAS# 7570-47-0) is a useful research chemical. |
Molecular Weight: | 176.17 |
Molecular Formula: | C9H8N2O2 |
Canonical SMILES: | CC1=CC2=C(N1)C=CC(=C2)[N+](=O)[O-] |
InChI: | InChI=1S/C9H8N2O2/c1-6-4-7-5-8(11(12)13)2-3-9(7)10-6/h2-5,10H,1H3 |
InChI Key: | IDJGRXQMAHESOD-UHFFFAOYSA-N |
Boiling Point: | 365.6 °C at 760 mmHg |
Density: | 1.355 g/cm3 |
Appearance: | Yellow to orange-brown crystalline powder |
MDL: | MFCD00090335 |
LogP: | 2.90770 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113248481-A | EZH2 covalent irreversible inhibitor, preparation method and application thereof | 20210419 |
WO-2020150446-A1 | Small molecule direct inhibitors of keap1-nrf2 protein-protein interaction | 20190118 |
WO-2020012424-A1 | Substituted (aza)indole derivatives | 20180713 |
JP-2019521162-A | Indole derivatives as CRTH2 inhibitors | 20160721 |
CN-105921173-A | Nano-silver composite textile catalyst and application thereof | 20160421 |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 176.058577502 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.058577502 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 61.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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