| CAS Number | 13037-87-1 |
| Catalog Number | AG000UCK(AGN-PC-0KVAQC) |
| Chemical Name | Phenol, 4-(dodecyloxy)- |
| IUPAC Name | 4-dodecoxyphenol |
| InChI | InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-16-20-18-14-12-17(19)13-15-18/h12-15,19H,2-11,16H2,1H3 |
| InChI Key | FHXJDKPJCDJBEM-UHFFFAOYSA-N |
| MDL Number | MFCD00224995 |
| Molecular Formula | C18H30O2 |
| Molecular Weight | 278.4296 |
| SMILES | OC1=CC=C(OCCCCCCCCCCCC)C=C1 |
| Synonyms | 4-DODECYLOXYPHENOL,
4-n-dodecyloxyphenol,
13037-87-1,
Phenol, 4-(dodecyloxy)-,
4-dodecoxyphenol,
4-dodecyloxy-phenol,
AC1MRCR2,
4-(DODECYLOXY)PHENOL,
SCHEMBL337589,
CTK0H3752,
DTXSID20392979,
ZINC3130442,
AKOS012857346,
MCULE-3474432214,
TL8000726,
I14-36880,
CID3490858,
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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 | 278.225g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.436g/mol |
| Monoisotopic Mass | 278.225g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number