| CAS Number | 581813-13-0 |
| Catalog Number | AG01A0IZ(AGN-PC-0NJFMF) |
| Chemical Name | (4-Tert-butylcyclohexyl)methanamine |
| IUPAC Name | (4-tert-butylcyclohexyl)methanamine |
| InChI | InChI=1S/C11H23N/c1-11(2,3)10-6-4-9(8-12)5-7-10/h9-10H,4-8,12H2,1-3H3 |
| InChI Key | KLWXMRDMJMWUER-UHFFFAOYSA-N |
| MDL Number | MFCD11641534 |
| Molecular Formula | C11H23N |
| Molecular Weight | 169.307 |
| SMILES | CC(C1CCC(CN)CC1)(C)C |
| Synonyms | (4-tert-butylcyclohexyl)methanamine,
581813-13-0,
SCHEMBL716535,
SCHEMBL1690378,
SCHEMBL1691043,
SCHEMBL14014310,
ZINC37245889,
AKOS009459814,
MCULE-2801994883,
NE20776,
Z1436181068,
|
| Complexity | 126 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.312g/mol |
| Monoisotopic Mass | 169.183g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number