| CAS Number | 57234-51-2 |
| Catalog Number | AG00IA79 |
| Chemical Name | 3-(Methoxymethyl)phenol |
| IUPAC Name | 3-(methoxymethyl)phenol |
| InChI | InChI=1S/C8H10O2/c1-10-6-7-3-2-4-8(9)5-7/h2-5,9H,6H2,1H3 |
| InChI Key | AAVSHQOVBKPECT-UHFFFAOYSA-N |
| MDL Number | MFCD14680990 |
| Molecular Formula | C8H10O2 |
| Molecular Weight | 138.1638 |
| SMILES | OC1=CC=CC(COC)=C1 |
| Synonyms | 3-(methoxymethyl)phenol,
57234-51-2,
Phenol, 3-(methoxymethyl)-,
SCHEMBL3150055,
CTK1F2581,
DTXSID00555722,
ZINC34224441,
AKOS010766056,
MCULE-2062381823,
NE15829,
EN300-75883,
Z1259161691,
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| Complexity | 93.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 138.166g/mol |
| Monoisotopic Mass | 138.068g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number