| CAS Number | 53732-26-6 |
| Catalog Number | AG00DEUB(AGN-PC-00KGG7) |
| Chemical Name | 2-[(2-Chloro-5-methylphenoxy)methyl]oxirane |
| IUPAC Name | 2-[(2-chloro-5-methylphenoxy)methyl]oxirane |
| InChI | InChI=1S/C10H11ClO2/c1-7-2-3-9(11)10(4-7)13-6-8-5-12-8/h2-4,8H,5-6H2,1H3 |
| InChI Key | DAGBZRAFMXTXNY-UHFFFAOYSA-N |
| MDL Number | MFCD11651661 |
| Molecular Formula | C10H11ClO2 |
| Molecular Weight | 198.6461 |
| SMILES | CC1=CC(OCC2OC2)=C(Cl)C=C1 |
| Synonyms | 53732-26-6,
2-[(2-Chloro-5-methylphenoxy)methyl]oxirane,
1-(2-chloro-5-methylphenoxy)-2,3-epoxypropane,
2-(2-chloro-5-methylphenoxymethyl)oxirane,
Oxirane, [(2-chloro-5-methylphenoxy)methyl]-,
SCHEMBL4947451,
CTK1G0286,
DTXSID00515149,
DAGBZRAFMXTXNY-UHFFFAOYSA-N,
AKOS009394083,
NE15254,
1-(2-chloro-5-methyl-phenoxy)-2,3-epoxypropane,
Oxirane, 2-[(2-chloro-5-methylphenoxy)methyl]-,
2-((2-chloro-5-methylphenoxy)methyl)oxirane,
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| Complexity | 174 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.646g/mol |
| Monoisotopic Mass | 198.045g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number