| CAS Number | 25199-00-2 |
| Catalog Number | AG002QV7(AGN-PC-0WAZZH) |
| Chemical Name | Pyrimidine, 4-chloro-5-propyl- |
| IUPAC Name | 4-chloro-5-propylpyrimidine |
| InChI | InChI=1S/C7H9ClN2/c1-2-3-6-4-9-5-10-7(6)8/h4-5H,2-3H2,1H3 |
| InChI Key | XFPJNYIBYZTJES-UHFFFAOYSA-N |
| MDL Number | MFCD09971219 |
| Molecular Formula | C7H9ClN2 |
| Molecular Weight | 156.6128 |
| SMILES | CCCC1=CN=CN=C1Cl |
| Synonyms | 4-CHLORO-5-PROPYLPYRIMIDINE,
25199-00-2,
CTK4F5181,
Pyrimidine, 4-chloro-5-propyl-,
DTXSID40650947,
FCH878903,
MFCD09971219,
ZINC19091768,
AKOS006311631,
AB55649,
GS-5623,
ACM25199002,
AJ-71686,
AB1007510,
CS-0045578,
KS-00002647,
null,
2-(Pyridin-3-yl)-1H-benzo[d]imidazole,
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| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 156.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 156.613g/mol |
| Monoisotopic Mass | 156.045g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number