| CAS Number | 1104793-69-2 |
| Catalog Number | AG01A99L |
| Chemical Name | N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide |
| IUPAC Name | N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide |
| InChI | InChI=1S/C16H15FN2O/c17-12-6-2-4-8-14(12)19-16(20)15-10-9-11-5-1-3-7-13(11)18-15/h1-8,15,18H,9-10H2,(H,19,20) |
| InChI Key | OOXBMAUZOQDCQM-UHFFFAOYSA-N |
| MDL Number | MFCD09929174 |
| Molecular Formula | C16H15FN2O |
| Molecular Weight | 270.3015 |
| SMILES | FC1=C(NC(C2NC3=C(C=CC=C3)CC2)=O)C=CC=C1 |
| Synonyms | N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide,
1104793-69-2,
AC1Q4LEG,
AKOS000166721,
MCULE-8554965158,
NE32066,
EN300-64525,
Z1183468881,
|
| Complexity | 349 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.117g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.307g/mol |
| Monoisotopic Mass | 270.117g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number