| CAS Number | 13887-74-6 |
| Catalog Number | AG007LII(AGN-PC-004KZD) |
| Chemical Name | 3,7-dimethyloctan-1-amine |
| IUPAC Name | 3,7-dimethyloctan-1-amine |
| InChI | InChI=1S/C10H23N/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8,11H2,1-3H3 |
| InChI Key | PPKSYRUVTABEIE-UHFFFAOYSA-N |
| MDL Number | MFCD09264303 |
| Molecular Formula | C10H23N |
| Molecular Weight | 157.2963 |
| SMILES | CC(CCCC(CCN)C)C |
| Synonyms | 3,7-DIMETHYLOCTAN-1-AMINE,
13887-74-6,
1-Octanamine, 3,7-dimethyl-,
3,7-dimethyl-octylamine,
3,7-Dimethyloctane-1-amine,
SCHEMBL277522,
CTK0F2886,
DTXSID80542135,
PPKSYRUVTABEIE-UHFFFAOYSA-N,
MFCD09264303,
AKOS006331817,
AS-44814,
|
| Complexity | 78.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.301g/mol |
| Monoisotopic Mass | 157.183g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number