5-Ethoxyindole - CAS 10501-17-4
Catalog: |
BB046728 |
Product Name: |
5-Ethoxyindole |
CAS: |
10501-17-4 |
Synonyms: |
1H-Indole, 5-ethoxy-; 5-Ethoxy-indole |
IUPAC Name: | 5-ethoxy-1H-indole |
Description: | 5-Ethoxyindole (CAS# 10501-17-4 ) is a useful research chemical. |
Molecular Weight: | 161.20 |
Molecular Formula: | C10H11NO |
Canonical SMILES: | CCOC1=CC2=C(C=C1)NC=C2 |
InChI: | InChI=1S/C10H11NO/c1-2-12-9-3-4-10-8(7-9)5-6-11-10/h3-7,11H,2H2,1H3 |
InChI Key: | IEKPDICCMASELW-UHFFFAOYSA-N |
Boiling Point: | 309.0±15.0 °C at 760 mmHg |
Melting Point: | 35-36 °C |
Purity: | 97 % |
Density: | 1.132±0.06 g/cm3 (Predicted) |
Appearance: | Dark grey low-melting solid |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 149 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.084063974 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.084063974 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 25 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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