| CAS Number | 87751-73-3 |
| Catalog Number | AG004FLS(AGN-PC-0OL92Y) |
| Chemical Name | 3-(3-Ethoxy-4-hydroxyphenyl)-2-phenylacrylic acid |
| IUPAC Name | (Z)-3-(3-ethoxy-4-hydroxyphenyl)-2-phenylprop-2-enoic acid |
| InChI | InChI=1S/C17H16O4/c1-2-21-16-11-12(8-9-15(16)18)10-14(17(19)20)13-6-4-3-5-7-13/h3-11,18H,2H2,1H3,(H,19,20)/b14-10- |
| InChI Key | MWAIANWSNPYYIQ-UVTDQMKNSA-N |
| MDL Number | MFCD04625515 |
| Molecular Formula | C17H16O4 |
| Molecular Weight | 284.3065 |
| SMILES | CCOC1=C(O)C=CC(C=C(C2=CC=CC=C2)C(O)=O)=C1 |
| Synonyms | (2Z)-3-(3-ethoxy-4-hydroxyphenyl)-2-phenylacrylic acid,
EN300-07243,
87751-73-3,
3-(3-ethoxy-4-hydroxyphenyl)-2-phenylprop-2-enoic acid,
AC1M6TRD,
AC1Q35TD,
SBB042835,
ZINC12504663,
AKOS000268855,
NE20544,
SR-01000047711,
SR-01000047711-1,
(2Z)-3-(3-ethoxy-4-hydroxyphenyl)-2-phenylprop-2-enoic acid,
(Z)-3-(3-ethoxy-4-hydroxyphenyl)-2-phenylprop-2-enoic acid,
(z)-3-(3-ethoxy-4-hydroxy-phenyl)-2-phenyl-acrylic acid, AldrichCPR,
CID2405247,
3-(3-ethoxy-4-hydroxy-phenyl)-2-phenyl-prop-2-enoic Acid,
(Z)-3-(3-ethoxy-4-hydroxy-phenyl)-2-phenyl-prop-2-enoate,
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| Complexity | 371 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 284.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 284.311g/mol |
| Monoisotopic Mass | 284.105g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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