| CAS Number | 1096790-46-3 |
| Catalog Number | AG019WAB(AGN-PC-0WO8BN) |
| Chemical Name | (4-ethylcyclohexyl)methanamine |
| IUPAC Name | (4-ethylcyclohexyl)methanamine |
| InChI | InChI=1S/C9H19N/c1-2-8-3-5-9(7-10)6-4-8/h8-9H,2-7,10H2,1H3 |
| InChI Key | NYZHAHHOBPMFSC-UHFFFAOYSA-N |
| MDL Number | MFCD11641535 |
| Molecular Formula | C9H19N |
| Molecular Weight | 141.2539 |
| SMILES | CCC1CCC(CN)CC1 |
| Synonyms | (4-ethylcyclohexyl)methanamine,
1096790-46-3,
AC1Q2UAT,
SCHEMBL178372,
SCHEMBL10269255,
SCHEMBL12441541,
SCHEMBL12820123,
ZINC36379741,
AKOS008129063,
NE15229,
EN300-51215,
(4-ethylcyclohexyl)methanamine, Mixture of isomers,
|
| Complexity | 82.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.152g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.258g/mol |
| Monoisotopic Mass | 141.152g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number