| CAS Number | 75677-09-7 |
| Catalog Number | AG005AIN(AGN-PC-09T14X) |
| Chemical Name | 3-(4-phenylphenyl)propanal |
| IUPAC Name | 3-(4-phenylphenyl)propanal |
| InChI | InChI=1S/C15H14O/c16-12-4-5-13-8-10-15(11-9-13)14-6-2-1-3-7-14/h1-3,6-12H,4-5H2 |
| InChI Key | QGJDVSWMEVFRCW-UHFFFAOYSA-N |
| MDL Number | MFCD09028657 |
| Molecular Formula | C15H14O |
| Molecular Weight | 210.2711 |
| SMILES | O=CCCC1=CC=C(C2=CC=CC=C2)C=C1 |
| Synonyms | [1,1'-Biphenyl]-4-propanal,
75677-09-7,
3-(4-phenylphenyl)propanal,
3-([1,1'-Biphenyl]-4-yl)propanal,
3-BIPHENYL-4-YL-PROPIONALDEHYDE,
3-(Biphenyl-4-yl)propanal,
SCHEMBL6641300,
CTK2H6628,
DTXSID30698893,
QGJDVSWMEVFRCW-UHFFFAOYSA-N,
ZINC88278178,
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| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.276g/mol |
| Monoisotopic Mass | 210.104g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
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Certificate of Analysis
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