| CAS Number | 522622-95-3 |
| Catalog Number | AG01A6ME(AGN-PC-0NHOGA) |
| Chemical Name | [3-(methoxymethyl)phenyl]methanol |
| IUPAC Name | [3-(methoxymethyl)phenyl]methanol |
| InChI | InChI=1S/C9H12O2/c1-11-7-9-4-2-3-8(5-9)6-10/h2-5,10H,6-7H2,1H3 |
| InChI Key | LCRNBZWULOCFRL-UHFFFAOYSA-N |
| MDL Number | MFCD21267294 |
| Molecular Formula | C9H12O2 |
| Molecular Weight | 152.1904 |
| SMILES | OCC1=CC=CC(COC)=C1 |
| Synonyms | [3-(methoxymethyl)phenyl]methanol,
522622-95-3,
Benzenemethanol, 3-(methoxymethyl)-,
(3-(methoxymethyl)phenyl)methanol,
SCHEMBL2567350,
3-(Methoxymethyl)benzyl alcohol,
CTK1G3016,
DTXSID60476909,
LCRNBZWULOCFRL-UHFFFAOYSA-N,
ZINC38844716,
AKOS014929302,
NE47938,
FT-0769693,
3-(methoxymethyl)Benzenemethanol,
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| Complexity | 104 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.193g/mol |
| Monoisotopic Mass | 152.084g/mol |
| Rotatable Bond Count | 3 |
| 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