| CAS Number | 790270-99-4 |
| Catalog Number | AG00ICZT(AGN-PC-0WQYDK) |
| Chemical Name | 2-Chloro-1-(4-ethoxyphenyl)propan-1-one |
| IUPAC Name | 2-chloro-1-(4-ethoxyphenyl)propan-1-one |
| InChI | InChI=1S/C11H13ClO2/c1-3-14-10-6-4-9(5-7-10)11(13)8(2)12/h4-8H,3H2,1-2H3 |
| InChI Key | LAMNMHPSWYPAHR-UHFFFAOYSA-N |
| MDL Number | MFCD06357865 |
| Molecular Formula | C11H13ClO2 |
| Molecular Weight | 212.6727 |
| SMILES | CCOC1=CC=C(C(C(Cl)C)=O)C=C1 |
| Synonyms | 2-chloro-1-(4-ethoxyphenyl)propan-1-one,
790270-99-4,
AC1N92VC,
AC1Q366G,
CTK6G1593,
MFCD06357865,
AKOS000200828,
AKOS017268718,
MCULE-9353025830,
NE52917,
EN300-10063,
ZINC03394168,
CID4354135,
|
| Complexity | 186 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.06g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.673g/mol |
| Monoisotopic Mass | 212.06g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number