| CAS Number | 30069-65-9 |
| Catalog Number | AG00BI53(AGN-PC-0LA6CR) |
| Chemical Name | 3-Phenylnaphthalen-1-ol |
| IUPAC Name | 3-phenylnaphthalen-1-ol |
| InChI | InChI=1S/C16H12O/c17-16-11-14(12-6-2-1-3-7-12)10-13-8-4-5-9-15(13)16/h1-11,17H |
| InChI Key | MAPYOCUYNJWAJW-UHFFFAOYSA-N |
| MDL Number | MFCD00474644 |
| Molecular Formula | C16H12O |
| Molecular Weight | 220.2659 |
| SMILES | OC1=C2C=CC=CC2=CC(C3=CC=CC=C3)=C1 |
| Synonyms | 3-phenylnaphthalen-1-ol,
30069-65-9,
3-phenyl-1-naphthol,
AC1N9CBA,
1-Naphthalenol, 3-phenyl-,
SCHEMBL589557,
MAPYOCUYNJWAJW-UHFFFAOYSA-N,
ZINC3172372,
MFCD00474644,
CS-0059971,
CID4383325,
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| Complexity | 244 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.271g/mol |
| Monoisotopic Mass | 220.089g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
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Certificate of Analysis
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