| CAS Number | 57463-05-5 |
| Catalog Number | AG00F11T(AGN-PC-0NI3U7) |
| Chemical Name | 6-Methoxy-2-methyl-3,4-dihydro-2H-1,4-benzoxazin-3-one |
| IUPAC Name | 6-methoxy-2-methyl-4H-1,4-benzoxazin-3-one |
| InChI | InChI=1S/C10H11NO3/c1-6-10(12)11-8-5-7(13-2)3-4-9(8)14-6/h3-6H,1-2H3,(H,11,12) |
| InChI Key | FTHIJRUPPWMSJE-UHFFFAOYSA-N |
| MDL Number | MFCD10699545 |
| Molecular Formula | C10H11NO3 |
| Molecular Weight | 193.1992 |
| SMILES | COC1=CC2=C(OC(C(N2)=O)C)C=C1 |
| Synonyms | 6-METHOXY-2-METHYL-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-3-ONE,
57463-05-5,
6-METHOXY-2-METHYL-2H-BENZO[B][1,4]OXAZIN-3(4H)-ONE,
SCHEMBL293466,
CTK8J4148,
FTHIJRUPPWMSJE-UHFFFAOYSA-N,
AKOS006305116,
MB08914,
MCULE-9592916433,
NE53209,
EN300-91741,
2-Methyl-6-methoxy-2H-1,4-benzooxazine-3(4H)-one,
Z1266854826,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.202g/mol |
| Monoisotopic Mass | 193.074g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number