| CAS Number | 467444-21-9 |
| Catalog Number | AG019S0Z(AGN-PC-0WOA5O) |
| Chemical Name | 4-methyl-N-[(oxolan-2-yl)methyl]cyclohexan-1-amine |
| IUPAC Name | 4-methyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine |
| InChI | InChI=1S/C12H23NO/c1-10-4-6-11(7-5-10)13-9-12-3-2-8-14-12/h10-13H,2-9H2,1H3 |
| InChI Key | PXDDZIWTUJYLBQ-UHFFFAOYSA-N |
| MDL Number | MFCD01453750 |
| Molecular Formula | C12H23NO |
| Molecular Weight | 197.3171 |
| SMILES | CC1CCC(NCC2OCCC2)CC1 |
| Synonyms | 4-methyl-N-(oxolan-2-ylmethyl)cyclohexan-1-amine,
467444-21-9,
Oprea1_388243,
AKOS000242947,
AKOS017274844,
MCULE-1535519109,
NE35444,
EN300-91369,
4-methyl-N-[(oxolan-2-yl)methyl]cyclohexan-1-amine,
Z90504166,
|
| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.322g/mol |
| Monoisotopic Mass | 197.178g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number