| CAS Number | 1820735-79-2 |
| Catalog Number | AG00I13F |
| Chemical Name | 1,2-Dichloro-3-(3-methoxypropoxy)benzene |
| IUPAC Name | 1,2-dichloro-3-(3-methoxypropoxy)benzene |
| InChI | InChI=1S/C10H12Cl2O2/c1-13-6-3-7-14-9-5-2-4-8(11)10(9)12/h2,4-5H,3,6-7H2,1H3 |
| InChI Key | IHXYHFCGRUXPDS-UHFFFAOYSA-N |
| MDL Number | MFCD28096654 |
| Molecular Formula | C10H12Cl2O2 |
| Molecular Weight | 235.1071 |
| SMILES | COCCCOc1cccc(c1Cl)Cl |
| Synonyms | 1,2-Dichloro-3-(3-methoxypropoxy)benzene,
1820735-79-2,
ZINC169725178,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.021g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.104g/mol |
| Monoisotopic Mass | 234.021g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number