(2E)-3-(Dimethylamino)-1-(2-pyridyl)-2-propen-1-one - CAS 123367-25-9
Catalog: |
BB067406 |
Product Name: |
(2E)-3-(Dimethylamino)-1-(2-pyridyl)-2-propen-1-one |
CAS: |
123367-25-9 |
Synonyms: |
(E)-3-(dimethylamino)-1-(pyridin-2-yl)prop-2-en-1-one; 3-(Dimethylamino)-1-(pyridin-2-yl)prop-2-en-1-one; 3-Dimethylamino-1-pyridin-2-yl-propenone; 3-(Dimethylamino)-1-(2-pyridyl)-2-propen-1-one; (2E)-3-(dimethylamino)-1-(pyridin-2-yl)prop-2-en-1-one; (E)-3-(dimethylamino)-1-pyridin-2-ylprop-2-en-1-one; (2E)-3-(Dimethylamino)-1-(2-pyridyl)-2-propen-1-one |
IUPAC Name: | (E)-3-(dimethylamino)-1-pyridin-2-ylprop-2-en-1-one |
Description: | (2E)-3-(Dimethylamino)-1-(2-pyridyl)-2-propen-1-one |
Molecular Weight: | 176.22 |
Molecular Formula: | C10H12N2O |
Canonical SMILES: | CN(C)C=CC(=O)C1=CC=CC=N1 |
InChI: | InChI=1S/C10H12N2O/c1-12(2)8-6-10(13)9-5-3-4-7-11-9/h3-8H,1-2H3/b8-6+ |
InChI Key: | BWERGHWJEBQNQV-SOFGYWHQSA-N |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/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: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 176.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 176.094963011 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 33.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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