| CAS Number | 896427-71-7 |
| Catalog Number | AG00IFSF(AGN-PC-0WQYM4) |
| Chemical Name | 4-(3,5-Dimethylphenyl)phenol |
| IUPAC Name | 4-(3,5-dimethylphenyl)phenol |
| InChI | InChI=1S/C14H14O/c1-10-7-11(2)9-13(8-10)12-3-5-14(15)6-4-12/h3-9,15H,1-2H3 |
| InChI Key | XOFCSEHNWYJNIO-UHFFFAOYSA-N |
| MDL Number | MFCD18312793 |
| Molecular Formula | C14H14O |
| Molecular Weight | 198.2604 |
| SMILES | c1c(ccc(c1)O)c1cc(cc(c1)C)C |
| Synonyms | 4-(3,5-DIMETHYLPHENYL)PHENOL,
896427-71-7,
3',5'-Dimethyl-[1,1'-biphenyl]-4-ol,
SCHEMBL1513679,
DTXSID60597209,
KM2857,
MFCD18312793,
ZINC65339927,
AKOS006318726,
3',5'-Dimethyl[1,1'-biphenyl]-4-ol,
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| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.104g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.265g/mol |
| Monoisotopic Mass | 198.104g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number