| CAS Number | 58114-57-1 |
| Catalog Number | AG019VH9(AGN-PC-0N4IGT) |
| Chemical Name | 4-Ethoxybutan-1-amine |
| IUPAC Name | 4-ethoxybutan-1-amine |
| InChI | InChI=1S/C6H15NO/c1-2-8-6-4-3-5-7/h2-7H2,1H3 |
| InChI Key | GDELFUQKNPLION-UHFFFAOYSA-N |
| MDL Number | MFCD09808783 |
| Molecular Formula | C6H15NO |
| Molecular Weight | 117.1894 |
| SMILES | CCOCCCCN |
| Synonyms | 4-ethoxybutan-1-amine,
58114-57-1,
4-ethoxy-butylamine,
5-Oxaheptane-1-amine,
SCHEMBL185787,
CTK7E8158,
AC1Q3870,
ZINC19394051,
AKOS000159451,
NE28017,
EN300-45238,
CID10441690,
|
| Complexity | 39.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 117.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 117.192g/mol |
| Monoisotopic Mass | 117.115g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number