Chemical Name - Acetoxy Ethyl Bromide
Mol Weight - 167.002
Smiles - CC(OCCBr)=O
Mol Weight - 167.002
Smiles - CC(OCCBr)=O
| Property Value | |
| Mol Name | Acetoxy Ethyl Bromide |
| Molweight | 167.002 |
| Monoisotopic Mass | 165.962941 |
| Clogp | 0.8954 |
| Clogs | -1.43 |
| H Acceptors | 2 |
| Total Surface Area | 99.66 |
| Relative Psa | 0.23119 |
| Polar Surface Area | 26.3 |
| Druglikeness | -7.3709 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Shape Index | 0.85714 |
| Molecular Flexibility | 0.51723 |
| Molecular Complexity | 0.53648 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 3 |
| Sp3 Atoms | 4 |
| Smiles | CC(OCCBr)=O |
| InChIKey | InChI=1S/C4H7BrO2/c1-4(6)7-3-2-5/h2-3H2,1H3 |
| InChI | RGHQKFQZGLKBCF-UHFFFAOYSA-N |
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1 - Acetoxy Ethyl Bromide
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1 - Acetoxy Ethyl Bromide
2 - Acetoxy Ethyl Bromide
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