| CAS Number | 204974-32-3 |
| Catalog Number | AG00BJ0G(AGN-PC-0O7GBX) |
| Chemical Name | (2E)-3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one |
| IUPAC Name | 3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one |
| InChI | InChI=1S/C15H11FO2/c16-13-6-1-11(2-7-13)3-10-15(18)12-4-8-14(17)9-5-12/h1-10,17H |
| InChI Key | NDVVHDJUSWOVOP-UHFFFAOYSA-N |
| MDL Number | MFCD00297565 |
| Molecular Formula | C15H11FO2 |
| Molecular Weight | 242.2450 |
| SMILES | FC2(=CC=C(C=CC(=O)C1(=CC=C(O)C=C1))C=C2) |
| Synonyms | 204974-32-3,
(2E)-3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one,
AC1MEYUM,
AKOS030241187,
MCULE-1584362694,
KS-00002764,
3-(4-fluorophenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one,
ZINC05094118,
CID2886363,
|
| Complexity | 298 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.249g/mol |
| Monoisotopic Mass | 242.074g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number