| CAS Number | 899809-61-1 |
| Catalog Number | AG00GV7X(AGN-PC-0WALPU) |
| Chemical Name | 4-hydroxy-N,N-diphenyl-(4R)-2-Pentynamide |
| IUPAC Name | (4R)-4-hydroxy-N,N-diphenylpent-2-ynamide |
| InChI | InChI=1S/C17H15NO2/c1-14(19)12-13-17(20)18(15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-11,14,19H,1H3/t14-/m1/s1 |
| InChI Key | YGFCFRBHEOHPJI-CQSZACIVSA-N |
| MDL Number | MFCD28972389 |
| Molecular Formula | C17H15NO2 |
| Molecular Weight | 265.3065 |
| SMILES | C[C@@H](O)C#CC(N(C1=CC=CC=C1)C2=CC=CC=C2)=O |
| Synonyms | (R)-4-hydroxy-N,N-diphenylpent-2-ynamide,
899809-61-1,
4-hydroxy-N,N-diphenyl-(4R)-2-PentynaMide,
(4R)-4-Hydroxy-N,N-diphenyl-2-pentynamide,
SCHEMBL471268,
(4R)-4-hydroxy-N,N-diphenylpent-2-ynamide,
YGFCFRBHEOHPJI-CQSZACIVSA-N,
MFCD28972389,
AKOS025395810,
ZINC113903079,
DS-8210,
KS-00000T20,
AC-30217,
(R)-N,N-Diphenyl-4-hydroxy-2-pentyneamide,
FT-0699176,
CS-O-13006,
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| Complexity | 362 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.312g/mol |
| Monoisotopic Mass | 265.11g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number