| CAS Number | 1384430-79-8 |
| Catalog Number | AG019YV1(AGN-PC-0WOV0X) |
| Chemical Name | 4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine hydrochloride |
| IUPAC Name | 4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine;hydrochloride |
| InChI | InChI=1S/C9H15N3O.ClH/c1-6-11-9(13-12-6)7-2-4-8(10)5-3-7;/h7-8H,2-5,10H2,1H3;1H |
| InChI Key | FJTKMKAFBQLCKS-UHFFFAOYSA-N |
| MDL Number | MFCD22196544 |
| Molecular Formula | C9H16ClN3O |
| Molecular Weight | 217.6958 |
| SMILES | Cl.CC1N=C(C2CCC(N)CC2)ON=1 |
| Synonyms | 4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine hydrochloride,
1384430-79-8,
AKOS026744185,
MCULE-2636715782,
NE41080,
Z1374884698,
4-(3-methyl-1,2,4-oxadiazol-5-yl)cyclohexan-1-amine hydrochloride, Mixture of diastereomers,
|
| Complexity | 168 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.697g/mol |
| Monoisotopic Mass | 217.098g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number