| CAS Number | 1820619-93-9 |
| Catalog Number | AG00I0L3 |
| Chemical Name | 3,4-Dibromo-1-tert-butylpyrazole |
| IUPAC Name | 3,4-dibromo-1-tert-butylpyrazole |
| InChI | InChI=1S/C7H10Br2N2/c1-7(2,3)11-4-5(8)6(9)10-11/h4H,1-3H3 |
| InChI Key | KAAHZPNICIZVMO-UHFFFAOYSA-N |
| MDL Number | MFCD26383414 |
| Molecular Formula | C7H10Br2N2 |
| Molecular Weight | 281.9757 |
| SMILES | Brc1nn(cc1Br)C(C)(C)C |
| Synonyms | 3,4-DIBROMO-1-TERT-BUTYLPYRAZOLE,
3,4-Dibromo-1-(tert-butyl)-1H-pyrazole,
1820619-93-9,
C7H10Br2N2,
KM3897,
ZINC95495604,
Y2432,
|
| Complexity | 144 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.919g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.979g/mol |
| Monoisotopic Mass | 279.921g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number