Ethylpyrazine - CAS 13925-00-3
Catalog: |
BB008915 |
Product Name: |
Ethylpyrazine |
CAS: |
13925-00-3 |
Synonyms: |
2-ethylpyrazine |
IUPAC Name: | 2-ethylpyrazine |
Description: | Ethylpyrazine (CAS# 13925-00-3) is a reagent used in the synthetic preparation of various pharmaceutical goods and has been screened for potential activities as H1-antihistamine. |
Molecular Weight: | 108.14 |
Molecular Formula: | C6H8N2 |
Canonical SMILES: | CCC1=NC=CN=C1 |
InChI: | InChI=1S/C6H8N2/c1-2-6-5-7-3-4-8-6/h3-5H,2H2,1H3 |
InChI Key: | KVFIJIWMDBAGDP-UHFFFAOYSA-N |
Boiling Point: | 152-153 °C |
Purity: | > 99.0 % (GC) |
Density: | 0.984 g/cm3 |
Appearance: | Clear colorless to yellow liquid |
MDL: | MFCD00006149 |
LogP: | 1.03900 |
Vapor Pressure: | 1.67 [mmHg] |
GHS Hazard Statement: | H226 (14.26%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-11033516-B1 | Combination therapies with disulfiram | 20200918 |
WO-2021127265-A1 | Compounds and probes for imaging huntingtin protein | 20191218 |
WO-2021127217-A1 | Combination anti-cancer therapies with inducers of iron-dependent cellular disassembly | 20191217 |
WO-2021102600-A1 | Benzyl piperazine compound, preparation method therefor and application thereof in antivirus | 20191129 |
WO-2021096860-A1 | Mcl1 inhibitors | 20191112 |
PMID | Publication Date | Title | Journal |
22972780 | 20120901 | Effect of sugars on liquid-vapour partition of volatile compounds in ready-to-drink coffee beverages | Journal of mass spectrometry : JMS |
21613503 | 20110525 | Similar odorants elicit different behavioral and physiological responses, some supersustained | The Journal of neuroscience : the official journal of the Society for Neuroscience |
17120096 | 20071001 | Degradation of 2,5-dimethylpyrazine by Rhodococcus erythropolis strain DP-45 isolated from a waste gas treatment plant of a fishmeal processing company | Biodegradation |
16933949 | 20060904 | Investigations on the synthesis, structures, and properties of new copper(I) 2,3-dimethylpyrazine coordination compounds | Inorganic chemistry |
15140253 | 20040512 | Pyrazine derivatives in cigarette smoke inhibit hamster oviductal functioning | Reproductive biology and endocrinology : RB&E |
Complexity: | 63.5 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 108.068748264 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 108.068748264 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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