TL;DR: Carbamic acid, dimethyl-, p-phenylene ester (2:1) (CAS 63884-51-5) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(dimethylcarbamoyloxy)phenyl] N,N-dimethylcarbamate
Also Known As: p-Phenylene dimethylcarbamate, 1,4-Phenylenecarbamicaciddimethylester, 1,4-Bis(dimethylcarbamoyloxy)benzene, NIOSH/FA2887500, Hydroquinone, bis(dimethylcarbamate)
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H16N2O4 |
| Molecular Weight | 252.11101 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11101 Da |
| Heavy Atoms | 18 |
| Complexity | 266.0 |
| SMILES | CN(C)C(=O)OC1=CC=C(C=C1)OC(=O)N(C)C |
| InChIKey | ULXRHTUWSOLFAL-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, dimethyl-, p-phenylene ester (2:1). With a topological polar surface area (TPSA) of 59.1 Ų, Carbamic acid, dimethyl-, p-phenylene ester (2:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, dimethyl-, p-phenylene ester (2:1) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Carbamic acid, dimethyl-, p-phenylene ester (2:1) is 63884-51-5.
The molecular formula of Carbamic acid, dimethyl-, p-phenylene ester (2:1) is C12H16N2O4.
The molecular weight of Carbamic acid, dimethyl-, p-phenylene ester (2:1) is 252.11101 g/mol.
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