| CAS Number | 56069-36-4 |
| Catalog Number | AG00IA08(AGN-PC-0JQBFR) |
| Chemical Name | 4-(2-Methylpropoxy)phenol |
| IUPAC Name | 4-(2-methylpropoxy)phenol |
| InChI | InChI=1S/C10H14O2/c1-8(2)7-12-10-5-3-9(11)4-6-10/h3-6,8,11H,7H2,1-2H3 |
| InChI Key | USCXXKRPGNJTMM-UHFFFAOYSA-N |
| MDL Number | MFCD11181741 |
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.2170 |
| NSC Number | 606093 |
| SMILES | CC(COC1=CC=C(O)C=C1)C |
| Synonyms | 4-(2-methylpropoxy)phenol,
56069-36-4,
Phenol, 4-(2-methylpropoxy)-,
4-isobutoxyphenol,
NSC606093,
AC1L748I,
AC1Q579M,
SCHEMBL3173896,
CTK1F5389,
DTXSID10326627,
ZINC1609199,
AKOS009316991,
MCULE-4226412599,
NE17844,
NSC-606093,
Z1836338845,
CID354394,
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| Complexity | 115 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 166.099g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 166.22g/mol |
| Monoisotopic Mass | 166.099g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number