| CAS Number | 23771-98-4 |
| Catalog Number | AG01AC8J |
| Chemical Name | 1-Benzyl-3-phenylpyrrolidin-3-ol |
| IUPAC Name | 1-benzyl-3-phenylpyrrolidin-3-ol |
| InChI | InChI=1S/C17H19NO/c19-17(16-9-5-2-6-10-16)11-12-18(14-17)13-15-7-3-1-4-8-15/h1-10,19H,11-14H2 |
| InChI Key | VTOJUZHJWUBFJD-UHFFFAOYSA-N |
| MDL Number | MFCD02637769 |
| Molecular Formula | C17H19NO |
| Molecular Weight | 253.3389 |
| SMILES | OC1(C2=CC=CC=C2)CN(CC2=CC=CC=C2)CC1 |
| Synonyms | 1-benzyl-3-phenylpyrrolidin-3-ol,
23771-98-4,
AC1NOPH7,
Cambridge id 6345486,
Oprea1_454115,
SCHEMBL10226080,
1-Benzyl-3-phenyl-3-pyrrolidinol,
AKOS023426569,
1-benzyl-3-phenyl-pyrrolidin-3-ol,
CID5092181,
|
| Complexity | 281 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.345g/mol |
| Monoisotopic Mass | 253.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number