| CAS Number | 93983-14-3 |
| Catalog Number | AG019ELN(AGN-PC-0KO039) |
| Chemical Name | 2-chloro-1-(chloromethyl)-3,4-dimethoxybenzene |
| EC Number | 301-302-8 |
| IUPAC Name | 2-chloro-1-(chloromethyl)-3,4-dimethoxybenzene |
| InChI | InChI=1S/C9H10Cl2O2/c1-12-7-4-3-6(5-10)8(11)9(7)13-2/h3-4H,5H2,1-2H3 |
| InChI Key | ZRCXRIHUKHLNFX-UHFFFAOYSA-N |
| MDL Number | MFCD18850385 |
| Molecular Formula | C9H10Cl2O2 |
| Molecular Weight | 221.0805 |
| SMILES | COC1=C(OC)C(Cl)=C(CCl)C=C1 |
| Synonyms | 2-Chloro-1-(chloromethyl)-3,4-dimethoxybenzene,
93983-14-3,
2-chloro-3,4-dimethoxybenzyl chloride,
EINECS 301-302-8,
AC1MIEGI,
CTK5H4463,
DTXSID80240169,
MFCD18850385,
ZINC33611382,
AKOS012942471,
AS-9733,
AM806917,
CS-0061980,
2-chloro-1-(chloromethyl)-3,4-dimethoxy-benzene,
C9-H10-Cl2-O2,
CID3023229,
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| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.006g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.077g/mol |
| Monoisotopic Mass | 220.006g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number