| CAS Number | 3516-65-2 |
| Catalog Number | AG00CZQP(AGN-PC-0JLQFX) |
| Chemical Name | 4-(4-methoxyphenyl)-2,5-dihydrofuran-2-one |
| EC Number | 222-520-9 |
| IUPAC Name | 3-(4-methoxyphenyl)-2H-furan-5-one |
| InChI | InChI=1S/C11H10O3/c1-13-10-4-2-8(3-5-10)9-6-11(12)14-7-9/h2-6H,7H2,1H3 |
| InChI Key | HQVKPLUNUVUKBI-UHFFFAOYSA-N |
| MDL Number | MFCD28049128 |
| Molecular Formula | C11H10O3 |
| Molecular Weight | 190.1953 |
| SMILES | COC1=CC=C(C2COC(=O)C=2)C=C1 |
| Synonyms | 4-(4-Methoxyphenyl)furan-2(5H)-one,
3516-65-2,
3-(4-methoxyphenyl)-2H-furan-5-one,
4-(4-Methoxyphenyl)-2(5H)-furanone,
EINECS 222-520-9,
AC1Q6BE2,
AC1L2S93,
CTK4H3808,
DTXSID60188656,
ZINC5733298,
AKOS034120194,
ACM3516652,
FCH3145986,
2(5H)-Furanone,4-(4-methoxyphenyl)-,
CID77051,
AR-1F6361,
C11-H10-O3,
36214-25-2,
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| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.198g/mol |
| Monoisotopic Mass | 190.063g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number