| CAS Number | 855474-56-5 |
| Catalog Number | AG01AMUA |
| Chemical Name | Butyl(hexan-2-YL)amine |
| IUPAC Name | N-butylhexan-2-amine |
| InChI | InChI=1S/C10H23N/c1-4-6-8-10(3)11-9-7-5-2/h10-11H,4-9H2,1-3H3 |
| InChI Key | IXDGIDFQIUYTSG-UHFFFAOYSA-N |
| MDL Number | MFCD12050868 |
| Molecular Formula | C10H23N |
| Molecular Weight | 157.2963 |
| SMILES | CCCCNC(CCCC)C |
| Synonyms | BUTYL(HEXAN-2-YL)AMINE,
855474-56-5,
90023-94-2,
N-Butylhexan-2-amine,
N-Butyl-2-hexaneamine,
sec-Hexanamine, N-butyl-,
CTK3I5379,
DTXSID00656344,
AKOS009949368,
J3.563.160G,
Z1703043162,
|
| Complexity | 71.3 |
| 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 | 7 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number