| CAS Number | 1343235-66-4 |
| Catalog Number | AG01C2SZ |
| Chemical Name | 2-{[4-(Methylsulfanyl)phenoxy]methyl}oxirane |
| IUPAC Name | 2-[(4-methylsulfanylphenoxy)methyl]oxirane |
| InChI | InChI=1S/C10H12O2S/c1-13-10-4-2-8(3-5-10)11-6-9-7-12-9/h2-5,9H,6-7H2,1H3 |
| InChI Key | QLDXAZRKYDWGGF-UHFFFAOYSA-N |
| MDL Number | MFCD18854653 |
| Molecular Formula | C10H12O2S |
| Molecular Weight | 196.2661 |
| SMILES | CSC1=CC=C(OCC2OC2)C=C1 |
| Synonyms | 2-{[4-(methylsulfanyl)phenoxy]methyl}oxirane,
1343235-66-4,
SCHEMBL7289046,
AKOS012958473,
2-[4-(methylsulfanyl)phenoxymethyl]oxirane,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 196.264g/mol |
| Monoisotopic Mass | 196.056g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 47.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number