| CAS Number | 34334-21-9 |
| Catalog Number | AG019S4L |
| Chemical Name | 1-(2-Chloroethoxy)-4-(methylsulfanyl)benzene |
| IUPAC Name | 1-(2-chloroethoxy)-4-methylsulfanylbenzene |
| InChI | InChI=1S/C9H11ClOS/c1-12-9-4-2-8(3-5-9)11-7-6-10/h2-5H,6-7H2,1H3 |
| InChI Key | KPJQXJMCLUPJEW-UHFFFAOYSA-N |
| MDL Number | MFCD18599847 |
| Molecular Formula | C9H11ClOS |
| Molecular Weight | 202.7010 |
| SMILES | CSC1=CC=C(OCCCl)C=C1 |
| Synonyms | 1-(2-chloroethoxy)-4-(methylsulfanyl)benzene,
34334-21-9,
p-Methylthiophenoxyaethylchlorid,
SCHEMBL11506830,
KPJQXJMCLUPJEW-UHFFFAOYSA-N,
ZINC71790312,
AKOS012959008,
NE23083,
1-chloro-2-[4-(methylthio)phenoxy]ethane,
EN300-91766,
|
| Complexity | 113 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.696g/mol |
| Monoisotopic Mass | 202.022g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 34.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number