| CAS Number | 858225-64-6 |
| Catalog Number | AG01BUXS |
| Chemical Name | 6-chloro-2,3-dihydro-1H-inden-5-amine |
| IUPAC Name | 6-chloro-2,3-dihydro-1H-inden-5-amine |
| InChI | InChI=1S/C9H10ClN/c10-8-4-6-2-1-3-7(6)5-9(8)11/h4-5H,1-3,11H2 |
| InChI Key | GVNFSQOSVGQWNQ-UHFFFAOYSA-N |
| MDL Number | MFCD20721164 |
| Molecular Formula | C9H10ClN |
| Molecular Weight | 167.6354 |
| SMILES | NC1=C(Cl)C=C2C(CCC2)=C1 |
| Synonyms | 6-chloro-2,3-dihydro-1H-inden-5-amine,
858225-64-6,
SCHEMBL3828409,
AKOS023778818,
ZINC108286935,
Z2687203705,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.636g/mol |
| Monoisotopic Mass | 167.05g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number