| CAS Number | 90609-95-3 |
| Catalog Number | AG019ZRL |
| Chemical Name | (3,4-dihydro-2H-1,4-benzoxazin-2-yl)methanol hydrochloride |
| IUPAC Name | 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol;hydrochloride |
| InChI | InChI=1S/C9H11NO2.ClH/c11-6-7-5-10-8-3-1-2-4-9(8)12-7;/h1-4,7,10-11H,5-6H2;1H |
| InChI Key | FIKOALZNWHBYLH-UHFFFAOYSA-N |
| MDL Number | MFCD11227231 |
| Molecular Formula | C9H12ClNO2 |
| Molecular Weight | 201.6501 |
| SMILES | Cl.OCC1OC2=C(C=CC=C2)NC1 |
| Synonyms | 3,4-dihydro-2H-1,4-benzoxazin-2-ylmethanol hydrochloride,
MFCD11227231,
90609-95-3,
SBB092826,
MCULE-6771984260,
NE56230,
RP25891,
(3,4-Dihydro-2H-1,4-benzoxazin-2-yl)methanol hydrochloride,
(3,4-Dihydro-2H-benzo[1,4]oxazin-2-yl)-methanol hydrochloride,
2-hydroxymethyl-3,4-dihydro-2H-benzo[1,4]oxazine hydrochloride,
C9H12ClNO2,
82756-74-9,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.65g/mol |
| Monoisotopic Mass | 201.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number