| CAS Number | 1158310-28-1 |
| Catalog Number | AG00J3II |
| Chemical Name | N-(3-pyridinylmethyl)cyclohexanamine dihydrochloride |
| IUPAC Name | N-(pyridin-3-ylmethyl)cyclohexanamine;dihydrochloride |
| InChI | InChI=1S/C12H18N2.2ClH/c1-2-6-12(7-3-1)14-10-11-5-4-8-13-9-11;;/h4-5,8-9,12,14H,1-3,6-7,10H2;2*1H |
| InChI Key | RQFDISPNEMUKLA-UHFFFAOYSA-N |
| MDL Number | MFCD06071930 |
| Molecular Formula | C12H20Cl2N2 |
| Molecular Weight | 263.2066 |
| SMILES | N1C=CC=C(CNC2CCCCC2)C=1.Cl.Cl |
| Synonyms | N-(3-Pyridinylmethyl)cyclohexanamine dihydrochloride,
1158310-28-1,
ZX-CM015565,
MFCD06071930,
Cyclohexyl-pyridin-3-ylmethyl-amine,
97247-37-5,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 262.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.206g/mol |
| Monoisotopic Mass | 262.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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