| CAS Number | 13719-57-8 |
| Catalog Number | AG0012XC(AGN-PC-0NGVFC) |
| Chemical Name | 2-Chloro-4-(chloromethyl)-1-methoxybenzene |
| IUPAC Name | 2-chloro-4-(chloromethyl)-1-methoxybenzene |
| InChI | InChI=1S/C8H8Cl2O/c1-11-8-3-2-6(5-9)4-7(8)10/h2-4H,5H2,1H3 |
| InChI Key | JAXSPAXDDROBLQ-UHFFFAOYSA-N |
| MDL Number | MFCD00068624 |
| Molecular Formula | C8H8Cl2O |
| Molecular Weight | 191.0545 |
| SMILES | ClC1=C(C=CC(=C1)CCl)OC |
| Synonyms | 13719-57-8,
2-chloro-4-(chloromethyl)-1-methoxybenzene,
3-CHLORO-4-METHOXYBENZYL CHLORIDE,
SCHEMBL4976340,
CTK4C0685,
DTXSID40457216,
JAXSPAXDDROBLQ-UHFFFAOYSA-N,
ZINC20522381,
NE23280,
AJ-77845,
1-Methoxy-2-chloro-4-(chloromethyl)benzene,
Benzene,2-chloro-4-(chloromethyl)-1-methoxy-,
Benzene, 2-chloro-4-(chloromethyl)-1-methoxy-,
CID11159814,
2-chloro-4-(chloromethyl)-1-methoxy-benzene,
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| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.051g/mol |
| Monoisotopic Mass | 189.995g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number