4-(1H-tetrazol-1-yl)phenyl 2-(4-chloro-3-methylphenoxy)propanoate
Chemical Structure Depiction of
4-(1H-tetrazol-1-yl)phenyl 2-(4-chloro-3-methylphenoxy)propanoate
4-(1H-tetrazol-1-yl)phenyl 2-(4-chloro-3-methylphenoxy)propanoate
Compound characteristics
| Compound ID: | D453-0592 |
| Compound Name: | 4-(1H-tetrazol-1-yl)phenyl 2-(4-chloro-3-methylphenoxy)propanoate |
| Molecular Weight: | 358.78 |
| Molecular Formula: | C17 H15 Cl N4 O3 |
| Smiles: | CC(C(=O)Oc1ccc(cc1)n1cnnn1)Oc1ccc(c(C)c1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0532 |
| logD: | 4.0532 |
| logSw: | -4.3554 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.171 |
| InChI Key: | XQAYCLYSWNKMQG-LBPRGKRZSA-N |