| CAS Number | 61563-27-7 |
| Catalog Number | AG00ELWD(AGN-PC-001Q3V) |
| Chemical Name | 2-Chloro-3-methylbenzyl alcohol |
| IUPAC Name | (2-chloro-3-methylphenyl)methanol |
| InChI | InChI=1S/C8H9ClO/c1-6-3-2-4-7(5-10)8(6)9/h2-4,10H,5H2,1H3 |
| InChI Key | CTGHPNGFROEADL-UHFFFAOYSA-N |
| MDL Number | MFCD12031743 |
| Molecular Formula | C8H9ClO |
| Molecular Weight | 156.6095 |
| SMILES | Cc1cccc(c1Cl)CO |
| Synonyms | 61563-27-7,
2-chloro-3-methylbenzyl alcohol,
(2-Chloro-3-methylphenyl)methanol,
2-chloro-3-methylbenzylalcohol,
SCHEMBL1438163,
CTK2D7375,
DTXSID00561388,
CTGHPNGFROEADL-UHFFFAOYSA-N,
Benzenemethanol,2-chloro-3-methyl-,
Benzenemethanol, 2-chloro-3-methyl-,
ZINC34311196,
(2-Chloro-3-methyl-phenyl)-methanol,
AKOS017517982,
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| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.609g/mol |
| Monoisotopic Mass | 156.034g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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