| CAS Number | 1227694-88-3 |
| Catalog Number | AG000JFZ(AGN-PC-0WD3TN) |
| Chemical Name | (E)-N-(3-(3-(Dimethylamino)acryloyl)phenyl)-N-methylacetamide |
| IUPAC Name | N-[3-[3-(dimethylamino)prop-2-enoyl]phenyl]-N-methylacetamide |
| InChI | InChI=1S/C14H18N2O2/c1-11(17)16(4)13-7-5-6-12(10-13)14(18)8-9-15(2)3/h5-10H,1-4H3 |
| InChI Key | CWHTXVLCGAQQRA-UHFFFAOYSA-N |
| MDL Number | MFCD09833226 |
| Molecular Formula | C14H18N2O2 |
| Molecular Weight | 246.3049 |
| SMILES | CN(C)C=CC(=O)C1=CC(=CC=C1)N(C)C(C)=O |
| Synonyms | 1227694-88-3,
N-[3-[(E)-3-(dimethylamino)prop-2-enoyl]phenyl]-N-methylacetamide,
AK141701,
N-[3-[3-(Dimethylamino)-1-oxo-2-propenyl]phenyl]-N-methylacetamide,
CWHTXVLCGAQQRA-UHFFFAOYSA-N,
KS-00000RV1,
AKOS030237602,
N-[3-[3-(Dimethylamino)-1-oxo-2-propenyl]-phenyl]-N-methyl acetamide,
N-[3-[3-(Dimethylamino)-1-oxo-2-propenyl]-phenyl]-N-methylacetamide,
(E)-N-(3-(3-(Dimethylamino)acryloyl)phenyl)-N-methylacetamide,
96605-65-1,
N-(3-(3-(DIMETHYLAMINO)ACRYLOYL)PHENYL)-N-METHYLACETAMIDE,
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| Complexity | 337 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.31g/mol |
| Monoisotopic Mass | 246.137g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 40.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number