| CAS Number | 3594-97-6 |
| Catalog Number | AG00I74H(AGN-PC-000LX2) |
| Chemical Name | 2-(2-Hydroxymethylphenyl)phenol |
| IUPAC Name | 2-[2-(hydroxymethyl)phenyl]phenol |
| InChI | InChI=1S/C13H12O2/c14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)15/h1-8,14-15H,9H2 |
| InChI Key | FGCSCCNLDZVFBI-UHFFFAOYSA-N |
| MDL Number | MFCD00590209 |
| Molecular Formula | C13H12O2 |
| Molecular Weight | 200.2332 |
| SMILES | OCc1ccccc1c1ccccc1O |
| Synonyms | 3594-97-6,
2-(2-HYDROXYMETHYLPHENYL)PHENOL,
2'-(Hydroxymethyl)[1,1'-biphenyl]-2-ol,
2'-(Hydroxymethyl)-[1,1'-biphenyl]-2-ol,
2'-Hydroxybiphenyl-2-methanol,
SCHEMBL16429324,
DTXSID70556600,
MFCD00590209,
ZINC65339928,
[1,1'-Biphenyl]-2-methanol, 2'-hydroxy-,
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| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.237g/mol |
| Monoisotopic Mass | 200.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 40.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number