TL;DR: tert-butyl N-(2,3-dihydroxypropyl)carbamate (CAS 125414-41-7) is a chemical compound with molecular formula C8H17NO4 and molecular weight 191.11575 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl N-(2,3-dihydroxypropyl)carbamate
Also Known As: tert-Butyl (2,3-dihydroxypropyl)carbamate, tert-Butyl N-(2,3-dihydroxypropyl)carbamate, N-Boc-serinol, 3-Bocamino-1,2-propanediol, N-Boc-3-amino-1,2-propanediol
| Molecular Formula | C8H17NO4 |
| Molecular Weight | 191.11575 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 78.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 191.11575 Da |
| Heavy Atoms | 13 |
| Complexity | 164.0 |
| SMILES | CC(C)(C)OC(=O)NCC(CO)O |
| InChIKey | OWAMQHJPVUGZSB-UHFFFAOYSA-N |
The XLogP value of -0.4 indicates that tert-butyl N-(2,3-dihydroxypropyl)carbamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.8 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-butyl N-(2,3-dihydroxypropyl)carbamate. Following Lipinski's Rule of Five, tert-butyl N-(2,3-dihydroxypropyl)carbamate has 3 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 tert-butyl N-(2,3-dihydroxypropyl)carbamate is 125414-41-7.
The molecular formula of tert-butyl N-(2,3-dihydroxypropyl)carbamate is C8H17NO4.
The molecular weight of tert-butyl N-(2,3-dihydroxypropyl)carbamate is 191.11575 g/mol.
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