| CAS Number | 152943-33-4 |
| Catalog Number | AG00ADA3(AGN-PC-01UCEI) |
| Chemical Name | 1-(3-Chlorophenyl)-2-hydroxypropan-1-one |
| IUPAC Name | 1-(3-chlorophenyl)-2-hydroxypropan-1-one |
| InChI | InChI=1S/C9H9ClO2/c1-6(11)9(12)7-3-2-4-8(10)5-7/h2-6,11H,1H3 |
| InChI Key | PRVHLTNNKRCHGO-UHFFFAOYSA-N |
| MDL Number | MFCD16165818 |
| Molecular Formula | C9H9ClO2 |
| Molecular Weight | 184.6196 |
| SMILES | CC(C(C1=CC(Cl)=CC=C1)=O)O |
| Synonyms | 152943-33-4,
1-(3-Chlorophenyl)-2-hydroxypropan-1-one,
1-(3-CHLOROPHENYL)-2-HYDROXY-1-PROPANONE,
1-Propanone, 1-(3-chlorophenyl)-2-hydroxy-,
SCHEMBL2070613,
CTK4C7635,
DTXSID00592793,
AKOS011305887,
FT-0664886,
C9 H9 Cl O2,
1-propanona, 1-(3-clorofenil)-2-hidroxi-,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.619g/mol |
| Monoisotopic Mass | 184.029g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
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Certificate of Analysis
Lot Number