| CAS Number | 1060817-13-1 |
| Catalog Number | AG0084EK(AGN-PC-0WB3WX) |
| Chemical Name | 1-[1-(3,5-dimethylphenyl)cyclopentyl]methanamine |
| IUPAC Name | [1-(3,5-dimethylphenyl)cyclopentyl]methanamine |
| InChI | InChI=1S/C14H21N/c1-11-7-12(2)9-13(8-11)14(10-15)5-3-4-6-14/h7-9H,3-6,10,15H2,1-2H3 |
| InChI Key | TYQXXAYOCSKPQM-UHFFFAOYSA-N |
| MDL Number | MFCD11053925 |
| Molecular Formula | C14H21N |
| Molecular Weight | 203.3232 |
| SMILES | C1(=CC(C)=CC(C)=C1)C1(CCCC1)CN |
| Synonyms | 1-[1-(3,5-DIMETHYLPHENYL)CYCLOPENTYL]METHANAMINE,
1060817-13-1,
(1-(3,5-Dimethylphenyl)cyclopentyl)methanamine,
CTK4A4357,
DTXSID60650984,
ZX-CM006207,
MFCD11053925,
ZINC19092602,
AKOS009547679,
AJ-71853,
Y-6522,
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| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 203.167g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.329g/mol |
| Monoisotopic Mass | 203.167g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Certificate of Analysis
Lot Number