| CAS Number | 1263059-15-9 |
| Catalog Number | AG000SJ5(AGN-PC-0WG3X5) |
| Chemical Name | 3-Bromo-5-methylpyrazolo[1,5-a]pyrimidine |
| IUPAC Name | 3-bromo-5-methylpyrazolo[1,5-a]pyrimidine |
| InChI | InChI=1S/C7H6BrN3/c1-5-2-3-11-7(10-5)6(8)4-9-11/h2-4H,1H3 |
| InChI Key | XYIJUNUYMCAQTR-UHFFFAOYSA-N |
| MDL Number | MFCD20230567 |
| Molecular Formula | C7H6BrN3 |
| Molecular Weight | 212.0466 |
| SMILES | CC1=NC2N(N=CC=2Br)C=C1 |
| Synonyms | 3-bromo-5-methylpyrazolo[1,5-a]pyrimidine,
1263059-15-9,
3-Bromo-5-methyl-pyrazolo[1,5-a]pyrimidine,
CTK4B5101,
DTXSID90718768,
KS-00001AQ2,
MFCD20230567,
ZINC71864020,
AKOS015994845,
ACN-043979,
RP26651,
AM805931,
TX-013065,
CS-0037071,
Pyrazolo[1,5-a]pyrimidine, 3-bromo-5-methyl-,
J-512039,
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| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.05g/mol |
| Monoisotopic Mass | 210.975g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 30.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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Certificate of Analysis
Lot Number