Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate
TL;DR: Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate (CAS 63981-89-5) is a chemical compound with molecular formula C16H25BrN2O2 and molecular weight 356.10995 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl-[4-(methylcarbamoyloxy)-2-propan-2-ylphenyl]-prop-2-enylazanium bromide
Also Known As: Ammonium, (4-methylcarbamoyloxy-o-cumenyl)allyldimethyl-, bromide, Carbamic acid, methyl-, (4-allyldimethylammonio)-m-cumenyl ester, bromide, AMMONIUM, (4-HYDROXY-o-CUMENYL)ALLYLDIMETHYL-, BROMIDE, METHYLCARBAMATE, Carbamic acid, N-methyl-, 3-isopropyl-4-dimethylaminophenyl ester, allylbromide, dimethyl-[4-(methylcarbamoyloxy)-2-propan-2-ylphenyl]-prop-2-enylazanium bromide
Technical Specifications
| Molecular Formula | C16H25BrN2O2 |
| Molecular Weight | 356.10995 g/mol |
| XLogP | 0.29 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 356.10995 Da |
| Heavy Atoms | 21 |
| Complexity | 339.0 |
| SMILES | CC(C)C1=C(C=CC(=C1)OC(=O)NC)[N+](C)(C)CC=C.[Br-] |
| InChIKey | NVKANBMTJYPYBP-UHFFFAOYSA-N |
Chemical Property Profile of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate
Property Insights of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate
The XLogP value of 0.29 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate?
The CAS number of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate is 63981-89-5.
What is the molecular formula of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate?
The molecular formula of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate is C16H25BrN2O2.
What is the molecular weight of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate?
The molecular weight of Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate is 356.10995 g/mol.
Where can I buy Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate?
You can request a quote for Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ammonium, (4-hydroxy-o-cumenyl)allyldimethyl-, bromide, methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.