| CAS Number | 1259077-49-0 |
| Catalog Number | AG01AF6B(AGN-PC-0WOAZN) |
| Chemical Name | (Azepan-4-yl)methanol |
| IUPAC Name | azepan-4-ylmethanol |
| InChI | InChI=1S/C7H15NO/c9-6-7-2-1-4-8-5-3-7/h7-9H,1-6H2 |
| InChI Key | ICMFRWRTMCSQFV-UHFFFAOYSA-N |
| MDL Number | MFCD18088890 |
| Molecular Formula | C7H15NO |
| Molecular Weight | 129.2001 |
| SMILES | OCC1CCNCCC1 |
| Synonyms | azepan-4-ylmethanol,
1259077-49-0,
(azepan-4-yl)methanol,
SCHEMBL2537127,
ICMFRWRTMCSQFV-UHFFFAOYSA-N,
AKOS006379273,
|
| Complexity | 75.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 129.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 129.203g/mol |
| Monoisotopic Mass | 129.115g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number