| CAS Number | 98555-67-0 |
| Catalog Number | AG00IK4P(AGN-PC-0WO4K1) |
| Chemical Name | 5,7-Dichloro-1,3-benzoxazol-2-amine |
| IUPAC Name | 5,7-dichloro-1,3-benzoxazol-2-amine |
| InChI | InChI=1S/C7H4Cl2N2O/c8-3-1-4(9)6-5(2-3)11-7(10)12-6/h1-2H,(H2,10,11) |
| InChI Key | NHDNAMKNESMSDH-UHFFFAOYSA-N |
| MDL Number | MFCD16742784 |
| Molecular Formula | C7H4Cl2N2O |
| Molecular Weight | 203.0255 |
| SMILES | NC1OC2=C(C=C(C=C2Cl)Cl)N=1 |
| Synonyms | 5,7-dichloro-1,3-benzoxazol-2-amine,
98555-67-0,
2-Amino-5,7-dichlorobenzoxazole,
ZINC52066075,
AKOS011654942,
NE44742,
SY130077,
MFCD16742784 (95%),
I14-9958,
Z2235675277,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.97g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 203.022g/mol |
| Monoisotopic Mass | 201.97g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 52A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number