| CAS Number | 6850-36-8 |
| Catalog Number | AG019MVD(AGN-PC-05J8YK) |
| Chemical Name | 2-Ethylcyclohexan-1-amine |
| IUPAC Name | 2-ethylcyclohexan-1-amine |
| InChI | InChI=1S/C8H17N/c1-2-7-5-3-4-6-8(7)9/h7-8H,2-6,9H2,1H3 |
| InChI Key | QOPVVDFTPKWSFL-UHFFFAOYSA-N |
| MDL Number | MFCD09035914 |
| Molecular Formula | C8H17N |
| Molecular Weight | 127.2273 |
| SMILES | CCC1C(N)CCCC1 |
| Synonyms | 2-ethylcyclohexan-1-amine,
2-ethylcyclohexylamine,
2-Ethylcyclohexanamine,
6850-36-8,
2-Ethyl-cyclohexylamine,
QOPVVDFTPKWSFL-UHFFFAOYSA-N,
AC1LBYTH,
AC1Q2UBO,
2-Ethylcyclohexanamine #,
SCHEMBL894914,
AKOS004117954,
AKOS022474393,
MCULE-3637799906,
NE62440,
EN300-37405,
2-ethylcyclohexan-1-amine, Mixture of diastereomers,
Z1245580411,
CID544854,
|
| Complexity | 80.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 127.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 127.231g/mol |
| Monoisotopic Mass | 127.136g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number