| CAS Number | 910381-50-9 |
| Catalog Number | AG019KE4(AGN-PC-0WO6CF) |
| Chemical Name | 2-(Quinolin-8-yl)ethan-1-amine |
| IUPAC Name | 2-quinolin-8-ylethanamine |
| InChI | InChI=1S/C11H12N2/c12-7-6-10-4-1-3-9-5-2-8-13-11(9)10/h1-5,8H,6-7,12H2 |
| InChI Key | AWLDVDHLEXTALM-UHFFFAOYSA-N |
| MDL Number | MFCD08449131 |
| Molecular Formula | C11H12N2 |
| Molecular Weight | 172.2264 |
| SMILES | NCCc1cccc2c1nccc2 |
| Synonyms | 2-(Quinolin-8-yl)ethan-1-amine,
910381-50-9,
2-quinolin-8-ylethanamine,
2-(QUINOLIN-8-YL)ETHANAMINE,
AC1Q54AA,
SCHEMBL6222571,
CTK5G8824,
DTXSID70585435,
MFCD08449131,
ZINC12505251,
AKOS009106544,
MCULE-5323989601,
NE57511,
AJ-62501,
BS-13792,
SC-59871,
EN300-26587,
Z228474558,
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| Complexity | 158 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.231g/mol |
| Monoisotopic Mass | 172.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number