| CAS Number | 24343-95-1 |
| Catalog Number | AG00BNMS(AGN-PC-0WNRHA) |
| Chemical Name | 5-bromo-2-methylpyrimidin-4-amine |
| IUPAC Name | 5-bromo-2-methylpyrimidin-4-amine |
| InChI | InChI=1S/C5H6BrN3/c1-3-8-2-4(6)5(7)9-3/h2H,1H3,(H2,7,8,9) |
| InChI Key | DJEJUOJXDWVFID-UHFFFAOYSA-N |
| MDL Number | MFCD00223699 |
| Molecular Formula | C5H6BrN3 |
| Molecular Weight | 188.0252 |
| SMILES | NC1=NC(C)=NC=C1Br |
| Synonyms | 5-bromo-2-methylpyrimidin-4-amine,
24343-95-1,
AC1Q2P1W,
SCHEMBL13328683,
CTK8E5204,
DTXSID00660481,
ZINC392459,
MFCD00223699,
AKOS006275496,
MCULE-7080637816,
NE48134,
AJ-21238,
AK139015,
EN000159,
TR-037097,
Z1362754518,
5-bromo-N-methylpyrimidin-4-amine,
56181-38-5,
|
| Complexity | 98.2 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.975g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.028g/mol |
| Monoisotopic Mass | 186.975g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H302
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P280-P305+P351+P338
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number