| CAS Number | 1086393-62-5 |
| Catalog Number | AG01AMTQ |
| Chemical Name | 3-(oxan-4-yl)propan-1-amine |
| IUPAC Name | 3-(oxan-4-yl)propan-1-amine |
| InChI | InChI=1S/C8H17NO/c9-5-1-2-8-3-6-10-7-4-8/h8H,1-7,9H2 |
| InChI Key | VIOABCQDSSRYIA-UHFFFAOYSA-N |
| MDL Number | MFCD11226126 |
| Molecular Formula | C8H17NO |
| Molecular Weight | 143.2267 |
| SMILES | C1COCCC1CCCN |
| Synonyms | 3-(OXAN-4-YL)PROPAN-1-AMINE,
1086393-62-5,
3-(TETRAHYDRO-2H-PYRAN-4-YL)PROPAN-1-AMINE,
SCHEMBL1052281,
VIOABCQDSSRYIA-UHFFFAOYSA-N,
ZINC35322918,
AKOS011673955,
AB64018,
MCULE-7895457492,
Z2218586135,
|
| Complexity | 79.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 143.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 143.23g/mol |
| Monoisotopic Mass | 143.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number