| CAS Number | 94540-41-7 |
| Catalog Number | AG01A1S9 |
| Chemical Name | Phenyl(1,2,3,4-tetrahydronaphthalen-1-yl)methanone |
| IUPAC Name | phenyl(1,2,3,4-tetrahydronaphthalen-1-yl)methanone |
| InChI | InChI=1S/C17H16O/c18-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)16/h1-5,7-9,11,16H,6,10,12H2 |
| InChI Key | PBOUTGGNTILOQZ-UHFFFAOYSA-N |
| MDL Number | MFCD17116599 |
| Molecular Formula | C17H16O |
| Molecular Weight | 236.3083 |
| SMILES | O=C(C1=CC=CC=C1)C1C2=C(C=CC=C2)CCC1 |
| Synonyms | phenyl(1,2,3,4-tetrahydronaphthalen-1-yl)methanone,
94540-41-7,
AKOS012010544,
MCULE-5672595689,
NE44854,
1-Benzoyl-1,2,3,4-tetrahydronaphthalene,
Z1492781264,
CID10421625,
Phenyl-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone,
|
| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.12g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.314g/mol |
| Monoisotopic Mass | 236.12g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number