| CAS Number | 959238-74-5 |
| Catalog Number | AG00IJJD(AGN-PC-07H9LX) |
| Chemical Name | 2-Bromo-5-isopropoxypyrazine |
| IUPAC Name | 2-bromo-5-propan-2-yloxypyrazine |
| InChI | InChI=1S/C7H9BrN2O/c1-5(2)11-7-4-9-6(8)3-10-7/h3-5H,1-2H3 |
| InChI Key | OWLUGZXLKGHHNQ-UHFFFAOYSA-N |
| MDL Number | MFCD09879034 |
| Molecular Formula | C7H9BrN2O |
| Molecular Weight | 217.0632 |
| SMILES | CC(C)OC1=NC=C(Br)N=C1 |
| Synonyms | 2-Bromo-5-isopropoxypyrazine,
959238-74-5,
SCHEMBL2169032,
CTK6B1007,
DTXSID30671686,
OWLUGZXLKGHHNQ-UHFFFAOYSA-N,
6588AC,
ANW-64817,
ZINC35635807,
AKOS015945363,
AB54269,
KS-9711,
2-Bromo-5-[(propan-2-yl)oxy]pyrazine,
AJ-91949,
TC-153562,
2-BROMO-5-(PROPAN-2-YLOXY)PYRAZINE,
FT-0712163,
C7H9BrN2O,
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| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.066g/mol |
| Monoisotopic Mass | 215.99g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number