Chemical Name - 1–Chloroethyl Chloroformate
Mol Weight - 142.969
Smiles - CC(OC(Cl)=O)Cl
Mol Weight - 142.969
Smiles - CC(OC(Cl)=O)Cl
| Property Value | |
| Mol Name | 1–Chloroethyl Chloroformate |
| Molweight | 142.969 |
| Monoisotopic Mass | 141.958834 |
| Clogp | 1.521 |
| Clogs | -2.26 |
| H Acceptors | 2 |
| Total Surface Area | 96.85 |
| Relative Psa | 0.23789 |
| Polar Surface Area | 26.3 |
| Druglikeness | -17.159 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | low |
| Shape Index | 0.71429 |
| Molecular Flexibility | 0.74038 |
| Molecular Complexity | 0.59725 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Stereo Centers | 1 |
| Rotatable Bonds | 2 |
| Sp3 Atoms | 3 |
| Smiles | CC(OC(Cl)=O)Cl |
| InChIKey | InChI=1S/C3H4Cl2O2/c1-2(4)7-3(5)6/h2H,1H3 |
| InChI | QOPVNWQGBQYBBP-UHFFFAOYSA-N |
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1 - 1–Chloroethyl Chloroformate
2 - 1–Chloroethyl Chloroformate
1 - 1–Chloroethyl Chloroformate
2 - 1–Chloroethyl Chloroformate
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