| CAS Number | 1803594-04-8 |
| Catalog Number | AG01B8BI |
| Chemical Name | 3-Amino-4-phenylbutan-1-ol hydrochloride |
| IUPAC Name | 3-amino-4-phenylbutan-1-ol;hydrochloride |
| InChI | InChI=1S/C10H15NO.ClH/c11-10(6-7-12)8-9-4-2-1-3-5-9;/h1-5,10,12H,6-8,11H2;1H |
| InChI Key | QXRHUIYSLIFLQD-UHFFFAOYSA-N |
| MDL Number | MFCD28246461 |
| Molecular Formula | C10H16ClNO |
| Molecular Weight | 201.6931 |
| SMILES | Cl.NC(CC1=CC=CC=C1)CCO |
| Synonyms | 3-amino-4-phenylbutan-1-ol hydrochloride,
1803594-04-8,
SCHEMBL18862999,
Z1992316427,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.694g/mol |
| Monoisotopic Mass | 201.092g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number