beta-Alanine, N-(3-(isooctyloxy)propyl)-
TL;DR: beta-Alanine, N-(3-(isooctyloxy)propyl)- (CAS 81611-35-0) is a chemical compound with molecular formula C14H29NO3 and molecular weight 259.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(6-methylheptoxy)propylamino]propanoic acid
Also Known As: N-(3-(Isooctyloxy)propyl)-beta-alanine, beta-Alanine, N-(3-(isooctyloxy)propyl)-, .beta.-Alanine, N-[3-(isooctyloxy)propyl]-, N-[3-(Isooctyloxy)propyl]-beta-alanine, N-[3-(6-Methylheptyloxy)propyl]-beta-alanine
| Molecular Formula | C14H29NO3 |
|---|---|
| Molecular Weight | 259.21 g/mol |
| LogP | 2.6738 |
| Topological Polar Surface Area | 58.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 259.21475 |
| Heavy Atoms | 18 |
| Complexity | 195.47812 |
Chemical Identifiers
| CAS Number | 81611-35-0 |
|---|---|
| SMILES | CC(C)CCCCCOCCCNCCC(=O)O |
Product Overview
beta-Alanine, N-(3-(isooctyloxy)propyl)- (CAS 81611-35-0), with molecular formula C14H29NO3 and molecular weight 259.21 g/mol. IUPAC: 3-[3-(6-methylheptoxy)propylamino]propanoic acid.
Chemical Property Profile of beta-Alanine, N-(3-(isooctyloxy)propyl)-
Property Insights of beta-Alanine, N-(3-(isooctyloxy)propyl)-
The XLogP value of 2.6738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Alanine, N-(3-(isooctyloxy)propyl)-. With a topological polar surface area (TPSA) of 58.56 Ų, beta-Alanine, N-(3-(isooctyloxy)propyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Alanine, N-(3-(isooctyloxy)propyl)- has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-Alanine, N-(3-(isooctyloxy)propyl)-?
The CAS number of beta-Alanine, N-(3-(isooctyloxy)propyl)- is 81611-35-0.
What is the molecular formula of beta-Alanine, N-(3-(isooctyloxy)propyl)-?
The molecular formula of beta-Alanine, N-(3-(isooctyloxy)propyl)- is C14H29NO3.
What is the molecular weight of beta-Alanine, N-(3-(isooctyloxy)propyl)-?
The molecular weight of beta-Alanine, N-(3-(isooctyloxy)propyl)- is 259.21 g/mol.
Where can I buy beta-Alanine, N-(3-(isooctyloxy)propyl)-?
You can request a quote for beta-Alanine, N-(3-(isooctyloxy)propyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Alanine, N-(3-(isooctyloxy)propyl)-?
Yes, KEHONG BIO provides custom synthesis services for beta-Alanine, N-(3-(isooctyloxy)propyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.