| CAS Number | 65623-40-7 |
| Catalog Number | AG01C45A(AGN-PC-0OFCF7) |
| Chemical Name | 2-(1,2,3,4-Tetrahydroquinolin-2-yl)ethan-1-ol |
| IUPAC Name | 2-(1,2,3,4-tetrahydroquinolin-2-yl)ethanol |
| InChI | InChI=1S/C11H15NO/c13-8-7-10-6-5-9-3-1-2-4-11(9)12-10/h1-4,10,12-13H,5-8H2 |
| InChI Key | XYKHXADEXVAGSF-UHFFFAOYSA-N |
| MDL Number | MFCD16293687 |
| Molecular Formula | C11H15NO |
| Molecular Weight | 177.2429 |
| SMILES | OCCC1NC2=C(C=CC=C2)CC1 |
| Synonyms | 65623-40-7,
2-(1,2,3,4-tetrahydroquinolin-2-yl)ethan-1-ol,
2-(2-hydroxyethyl)-1,2,3,4-tetrahydroquinoline,
AKOS033883600,
2-Quinolineethanol,1,2,3,4-tetrahydro-,
Z2379087997,
|
| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.115364g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.24g/mol |
| Monoisotopic Mass | 177.115364g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 32.3Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number