| CAS Number | 1545810-10-3 |
| Catalog Number | AG01AX4I |
| Chemical Name | N-(4-chloro-2-methylphenyl)-2-methyloxolan-3-amine |
| IUPAC Name | N-(4-chloro-2-methylphenyl)-2-methyloxolan-3-amine |
| InChI | InChI=1S/C12H16ClNO/c1-8-7-10(13)3-4-11(8)14-12-5-6-15-9(12)2/h3-4,7,9,12,14H,5-6H2,1-2H3 |
| InChI Key | GTYTVFWCYRIHFR-UHFFFAOYSA-N |
| MDL Number | MFCD24292873 |
| Molecular Formula | C12H16ClNO |
| Molecular Weight | 225.7145 |
| SMILES | CC1C(NC2=C(C)C=C(Cl)C=C2)CCO1 |
| Synonyms | N-(4-chloro-2-methylphenyl)-2-methyloxolan-3-amine,
1545810-10-3,
AKOS021045118,
EN300-163612,
|
| Complexity | 212 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.716g/mol |
| Monoisotopic Mass | 225.092g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number