Chemical Name - 2,4-Dichloropyrimidine
Mol Weight - 148.98
Smiles - Clc1ccnc(Cl)n1
InChI - BTTNYQZNBZNDOR-UHFFFAOYSA-N
InChIKey - InChI=1S/C4H2Cl2N2/c5-3-1-2-7-4(6)8-3/h1-2H
Mol Weight - 148.98
Smiles - Clc1ccnc(Cl)n1
InChI - BTTNYQZNBZNDOR-UHFFFAOYSA-N
InChIKey - InChI=1S/C4H2Cl2N2/c5-3-1-2-7-4(6)8-3/h1-2H
| Property Value | |
| Mol Name | 2,4-Dichloropyrimidine |
| Molweight | 148.98 |
| Monoisotopic Mass | 147.959502 |
| Clogp | 1.6479 |
| Clogs | -1.616 |
| H Acceptors | 2 |
| Total Surface Area | 101.62 |
| Relative Psa | 0.2159 |
| Polar Surface Area | 25.78 |
| Druglikeness | -1.689 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.625 |
| Molecular Complexity | 0.62123 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Aromatic Nitrogens | 2 |
| Smiles | Clc1ccnc(Cl)n1 |
| InChIKey | InChI=1S/C4H2Cl2N2/c5-3-1-2-7-4(6)8-3/h1-2H |
| InChI | BTTNYQZNBZNDOR-UHFFFAOYSA-N |
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1 - 2,4-Dichloropyrimidine
2 - 2,4-Dichloropyrimidine
1 - 2,4-Dichloropyrimidine
2 - 2,4-Dichloropyrimidine
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