| CAS Number | 855590-29-3 |
| Catalog Number | AG01B17D(AGN-PC-0WOSXB) |
| Chemical Name | 4-methylcycloheptan-1-amine |
| IUPAC Name | 4-methylcycloheptan-1-amine |
| InChI | InChI=1S/C8H17N/c1-7-3-2-4-8(9)6-5-7/h7-8H,2-6,9H2,1H3 |
| InChI Key | SFEOFFIWPWOBFJ-UHFFFAOYSA-N |
| MDL Number | MFCD19206728 |
| Molecular Formula | C8H17N |
| Molecular Weight | 127.2273 |
| SMILES | CC1CCC(N)CCC1 |
| Synonyms | 4-methylcycloheptan-1-amine,
855590-29-3,
SCHEMBL11522682,
AKOS006364282,
NE29448,
|
| 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 | 0 |
| 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