| CAS Number | 1173183-85-1 |
| Catalog Number | AG0094AR(AGN-PC-0WNMPR) |
| Chemical Name | 7-Chloro-2-methyl-3,4-dihydro-2H-1,4-benzoxazine |
| IUPAC Name | 7-chloro-2-methyl-3,4-dihydro-2H-1,4-benzoxazine |
| InChI | InChI=1S/C9H10ClNO/c1-6-5-11-8-3-2-7(10)4-9(8)12-6/h2-4,6,11H,5H2,1H3 |
| InChI Key | MNCYCJSKIJWGKE-UHFFFAOYSA-N |
| MDL Number | MFCD20687056 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | CC1OC2=C(C=CC(=C2)Cl)NC1 |
| Synonyms | 7-Chloro-2-methyl-3,4-dihydro-2H-1,4-benzoxazine,
1173183-85-1,
AKOS017531534,
Z7825,
2-Methyl-7-chloro-3,4-dihydro-2H-1,4-benzooxazine,
C9H10ClNO,
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| Complexity | 165 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.635g/mol |
| Monoisotopic Mass | 183.045g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number