| CAS Number | 54198-82-2 |
| Catalog Number | AG00DELB(AGN-PC-0NJK6Z) |
| Chemical Name | Pyrimidine, 5-chloro-4-methyl- |
| IUPAC Name | 5-chloro-4-methylpyrimidine |
| InChI | InChI=1S/C5H5ClN2/c1-4-5(6)2-7-3-8-4/h2-3H,1H3 |
| InChI Key | NAKUGAXAKDTKMT-UHFFFAOYSA-N |
| MDL Number | MFCD06209038 |
| Molecular Formula | C5H5ClN2 |
| Molecular Weight | 128.5596 |
| SMILES | Cc1c(cncn1)Cl |
| Synonyms | 5-CHLORO-4-METHYLPYRIMIDINE,
54198-82-2,
Pyrimidine, 5-chloro-4-methyl-,
PubChem16949,
SCHEMBL8313228,
ZINC14982422,
AKOS006304560,
LS21219,
AB1007520,
DB-081934,
CS-0045586,
4-Chloro-6-methylpyrimidine,
Pyrimidine, 5-chloro-4-methyl- (9CI),
3435-25-4,
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| Complexity | 76.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.014126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.56g/mol |
| Monoisotopic Mass | 128.014126g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 25.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number