| CAS Number | 1039881-41-8 |
| Catalog Number | AG01C1YX |
| Chemical Name | 7-chloro-8-fluoro-1,2,3,4-tetrahydroquinoline |
| IUPAC Name | 7-chloro-8-fluoro-1,2,3,4-tetrahydroquinoline |
| InChI | InChI=1S/C9H9ClFN/c10-7-4-3-6-2-1-5-12-9(6)8(7)11/h3-4,12H,1-2,5H2 |
| InChI Key | QYYBAOYQQFFUAA-UHFFFAOYSA-N |
| MDL Number | MFCD11192412 |
| Molecular Formula | C9H9ClFN |
| Molecular Weight | 185.6259 |
| SMILES | FC1=C2C(CCCN2)=CC=C1Cl |
| Synonyms | 7-chloro-8-fluoro-1,2,3,4-tetrahydroquinoline,
1039881-41-8,
ZINC20472508,
AKOS009249726,
Z2240988385,
|
| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 185.626g/mol |
| Monoisotopic Mass | 185.041g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number