| CAS Number | 33328-29-9 |
| Catalog Number | AG01CKUG(AGN-PC-001AOG) |
| Chemical Name | Quinoline, 2-(2-propenyl)- |
| IUPAC Name | 2-prop-2-enylquinoline |
| InChI | InChI=1S/C12H11N/c1-2-5-11-9-8-10-6-3-4-7-12(10)13-11/h2-4,6-9H,1,5H2 |
| InChI Key | NUGZWESJXYMAEW-UHFFFAOYSA-N |
| MDL Number | MFCD18448670 |
| Molecular Formula | C12H11N |
| Molecular Weight | 169.2224 |
| SMILES | C(C=C)C1=NC2=CC=CC=C2C=C1 |
| Synonyms | allylquinoline,
E-(2-quinolyl)propene,
SCHEMBL322184,
Quinoline, 2-(2-propenyl)-,
ZINC34288282,
33328-29-9,
55570-33-7,
2-(2-propenyl)quinoline,
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| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.227g/mol |
| Monoisotopic Mass | 169.089g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number