2-(1H-Indol-4-yl)ethanamine - CAS 16176-73-1
Catalog: |
BB011778 |
Product Name: |
2-(1H-Indol-4-yl)ethanamine |
CAS: |
16176-73-1 |
Synonyms: |
2-(1H-indol-4-yl)ethanamine; 2-(1H-indol-4-yl)ethanamine |
IUPAC Name: | 2-(1H-indol-4-yl)ethanamine |
Description: | 2-(1H-Indol-4-yl)ethanamine (CAS# 16176-73-1) is a useful research chemical. |
Molecular Weight: | 160.22 |
Molecular Formula: | C10H12N2 |
Canonical SMILES: | C1=CC(=C2C=CNC2=C1)CCN |
InChI: | InChI=1S/C10H12N2/c11-6-4-8-2-1-3-10-9(8)5-7-12-10/h1-3,5,7,12H,4,6,11H2 |
InChI Key: | XBARKDQKGSJDLG-UHFFFAOYSA-N |
Boiling Point: | 342.5 °C at 760 mmHg |
Density: | 1.157 g/cm3 |
LogP: | 2.36940 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-109824678-B | Azole indole alkaloid, preparation and antimalarial application thereof | 20190320 |
CN-108993496-B | Preparation method of ropinirole intermediate for treating dyskinesia | 20181030 |
US-2021053997-A1 | Trna synthetase inhibitors | 20180112 |
CN-110621667-A | Pyrimidine derivatives | 20170518 |
EP-3625223-A1 | Pyrimidine derivatives | 20170518 |
PMID | Publication Date | Title | Journal |
22590373 | 20120501 | [2-(1H-Indol-4-yl)eth-yl]dipropyl-amine | Acta crystallographica. Section E, Structure reports online |
Complexity: | 147 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.100048391 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.100048391 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 41.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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Amines and Anilines
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