| CAS Number | 66931-56-4 |
| Catalog Number | AG019JH2(AGN-PC-0KHDW6) |
| Chemical Name | 2-{[(2-chlorophenyl)methoxy]methyl}oxirane |
| IUPAC Name | 2-[(2-chlorophenyl)methoxymethyl]oxirane |
| InChI | InChI=1S/C10H11ClO2/c11-10-4-2-1-3-8(10)5-12-6-9-7-13-9/h1-4,9H,5-7H2 |
| InChI Key | QIGRNFRVHVCFEF-UHFFFAOYSA-N |
| MDL Number | MFCD06357341 |
| Molecular Formula | C10H11ClO2 |
| Molecular Weight | 198.6461 |
| SMILES | ClC1=C(COCC2OC2)C=CC=C1 |
| Synonyms | 2-{[(2-chlorophenyl)methoxy]methyl}oxirane,
66931-56-4,
2-{[(2-chlorobenzyl)oxy]methyl}oxirane,
AC1N9KVC,
AC1Q3KEI,
SCHEMBL10844477,
CTK6H3348,
AKOS000198083,
AKOS017268692,
NE17776,
2-[(2-chlorophenyl)methoxymethyl]oxirane,
EN300-09425,
ZINC03389558,
CID4387168,
1-(2-chlorobenzyloxy)-2,3-epoxypropane,
|
| Complexity | 163 |
| 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 | 4 |
| Topological Polar Surface Area | 21.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number