| CAS Number | 34147-55-2 |
| Catalog Number | AG019X3V(AGN-PC-01UY9H) |
| Chemical Name | (3-Methylcyclohexyl)methanamine |
| IUPAC Name | (3-methylcyclohexyl)methanamine |
| InChI | InChI=1S/C8H17N/c1-7-3-2-4-8(5-7)6-9/h7-8H,2-6,9H2,1H3 |
| InChI Key | AVBFYDXLBKBKNT-UHFFFAOYSA-N |
| MDL Number | MFCD11641530 |
| Molecular Formula | C8H17N |
| Molecular Weight | 127.2273 |
| SMILES | CC1CC(CCC1)CN |
| Synonyms | (3-methylcyclohexyl)methanamine,
34147-55-2,
AC1Q2QZY,
SCHEMBL715682,
3-aminomethyl-1-methylcyclohexane,
AVBFYDXLBKBKNT-UHFFFAOYSA-N,
AKOS009459642,
MCULE-5692325071,
NE22228,
AM806484,
EN300-53978,
1-(3-Methylcyclohexyl)methanamine,
|
| 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