4-(2-Aminoethyl)aniline - CAS 13472-00-9
Catalog: |
BB007996 |
Product Name: |
4-(2-Aminoethyl)aniline |
CAS: |
13472-00-9 |
Synonyms: |
4-(2-aminoethyl)aniline |
IUPAC Name: | 4-(2-aminoethyl)aniline |
Description: | 4-(2-Aminoethyl)aniline (CAS# 13472-00-9) is an efficient sorbent for the separation of dopamine. |
Molecular Weight: | 136.19 |
Molecular Formula: | C8H12N2 |
Canonical SMILES: | C1=CC(=CC=C1CCN)N |
InChI: | InChI=1S/C8H12N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5-6,9-10H2 |
InChI Key: | LNPMZQXEPNWCMG-UHFFFAOYSA-N |
Boiling Point: | 103 °C (0.3 mmHg) |
Melting Point: | 28 °C |
Purity: | 95 % |
Density: | 1.057 g/cm3 |
Appearance: | Light yellow solid or liquid |
Storage: | Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00008194 |
LogP: | 2.05150 |
GHS Hazard Statement: | H302 (11.36%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501 |
Signal Word: | Danger |
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PMID | Publication Date | Title | Journal |
22644595 | 20120707 | A sting in the tail of flexible molecules: spectroscopic and energetic challenges in the case of p-aminophenethylamine | Physical chemistry chemical physics : PCCP |
22195727 | 20120120 | Rational and predictable chemoselective synthesis of oligoamines via Buchwald-Hartwig amination of (hetero)aryl chlorides employing Mor-DalPhos | The Journal of organic chemistry |
21225247 | 20110301 | Functionalization of platinum nanoparticles for electrochemical detection of nitrite | Analytical and bioanalytical chemistry |
21126022 | 20110113 | Virtual screening identification of nonfolate compounds, including a CNS drug, as antiparasitic agents inhibiting pteridine reductase | Journal of medicinal chemistry |
20431189 | 20100528 | A functional carbohydrate chip platform for analysis of carbohydrate-protein interaction | Nanotechnology |
Complexity: | 85.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.100048391 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.100048391 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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