3-Bromoimidazo[1,2-a]pyrimidine - CAS 6840-45-5
Catalog: |
BB071422 |
Product Name: |
3-Bromoimidazo[1,2-a]pyrimidine |
CAS: |
6840-45-5 |
Synonyms: |
3-Bromoimidazo[1,2-a]pyrimidine; IMIDAZO[1,2-A]PYRIMIDINE, 3-BROMO-; 3-bromoimidazol-(1,2-a)-pyrimidine; 3-bromoimidazo(1,2-a)pyrimidine |
IUPAC Name: | 3-bromoimidazo[1,2-a]pyrimidine |
Description: | 3-Bromoimidazo[1,2-a]pyrimidine |
Molecular Weight: | 198.02 |
Molecular Formula: | C6H4BrN3 |
Canonical SMILES: | C1=CN2C(=CN=C2N=C1)Br |
InChI: | InChI=1S/C6H4BrN3/c7-5-4-9-6-8-2-1-3-10(5)6/h1-4H |
InChI Key: | GNHZXUKWLSWKHB-UHFFFAOYSA-N |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P316, P321, P330, P405, and P501 |
Signal Word: | Danger |
Complexity: | 130 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.95886 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.95886 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 30.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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