| CAS Number | 862574-70-7 |
| Catalog Number | AG008EZM(AGN-PC-0V3GAS) |
| Chemical Name | 3-(2-Chloro-6-fluorophenyl)propan-1-ol |
| IUPAC Name | 3-(2-chloro-6-fluorophenyl)propan-1-ol |
| InChI | InChI=1S/C9H10ClFO/c10-8-4-1-5-9(11)7(8)3-2-6-12/h1,4-5,12H,2-3,6H2 |
| InChI Key | AMHLSBIWZHOZLQ-UHFFFAOYSA-N |
| MDL Number | MFCD09028689 |
| Molecular Formula | C9H10ClFO |
| Molecular Weight | 188.6265 |
| SMILES | OCCCC1=C(Cl)C=CC=C1F |
| Synonyms | 3-(2-chloro-6-fluorophenyl)propan-1-ol,
862574-70-7,
3-(2-CHLORO-6-FLUORO-PHENYL)-PROPAN-1-OL,
Benzenepropanol,2-chloro-6-fluoro-,
AC1Q7CNK,
SCHEMBL2199784,
CTK5F6426,
DTXSID30651241,
AMHLSBIWZHOZLQ-UHFFFAOYSA-N,
Benzenepropanol, 2-chloro-6-fluoro-,
ZINC19729354,
AKOS005217783,
MCULE-3589507775,
NE22027,
3-(2-chloro-6-fluorophenyl)-1-propanol,
EN300-73240,
Z1250132581,
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| Complexity | 132 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.626g/mol |
| Monoisotopic Mass | 188.04g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number