Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate
TL;DR: Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate (CAS 63991-60-6) is a chemical compound with molecular formula C17H31NO4S and molecular weight 345.1974 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
heptyl-[(4-propan-2-ylphenyl)methyl]azanium;hydrogen sulfate
Also Known As: p-Isopropylbenzylheptylamine sulfate, BENZYLAMINE, N-HEPTYL-p-ISOPROPYL-, HYDROGEN SULFATE, Heptylamine, N-(p-isopropylbenzyl)-, hydrogen sulfate, heptyl-[(4-propan-2-ylphenyl)methyl]azanium; hydrogen sulfate, Benzenemethanamine, N-heptyl-4-(1-methylethyl)-, sulfate (1:1)
Technical Specifications
| Molecular Formula | C17H31NO4S |
| Molecular Weight | 345.1974 g/mol |
| XLogP | 2.85 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 345.1974 Da |
| Heavy Atoms | 23 |
| Complexity | 256.0 |
| SMILES | CCCCCCC[NH2+]CC1=CC=C(C=C1)C(C)C.OS(=O)(=O)[O-] |
| InChIKey | CMXAHMLCIIBQND-UHFFFAOYSA-N |
Chemical Property Profile of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate
Property Insights of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate
The XLogP value of 2.85 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate. Following Lipinski's Rule of Five, Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate?
The CAS number of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate is 63991-60-6.
What is the molecular formula of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate?
The molecular formula of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate is C17H31NO4S.
What is the molecular weight of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate?
The molecular weight of Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate is 345.1974 g/mol.
Where can I buy Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate?
You can request a quote for Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate?
Yes, CoreyChem provides custom synthesis services for Benzylamine, N-heptyl-p-isopropyl-, hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.