| CAS Number | 1354953-75-5 |
| Catalog Number | AG019SYH(AGN-PC-0WO7K9) |
| Chemical Name | N,N-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-7-amine |
| IUPAC Name | N,N-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-7-amine |
| InChI | InChI=1S/C10H14N2O/c1-12(2)8-3-4-9-10(7-8)13-6-5-11-9/h3-4,7,11H,5-6H2,1-2H3 |
| InChI Key | UBRIHYSSFWNSFF-UHFFFAOYSA-N |
| MDL Number | MFCD20731170 |
| Molecular Formula | C10H14N2O |
| Molecular Weight | 178.2310 |
| SMILES | CN(C1=CC2=C(NCCO2)C=C1)C |
| Synonyms | N,N-dimethyl-3,4-dihydro-2H-1,4-benzoxazin-7-amine,
1354953-75-5,
ZINC71790794,
AKOS024015478,
NE32336,
|
| Complexity | 172 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.235g/mol |
| Monoisotopic Mass | 178.111g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
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Certificate of Analysis
Lot Number