beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-
TL;DR: beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- (CAS 10526-63-3) is a chemical compound with molecular formula C8H14N4O8 and molecular weight 294.08118 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-[2-carboxyethyl(nitro)amino]ethyl-nitroamino]propanoic acid
Also Known As: beta-ALANINE, N,N'-(1,2-ETHANEDIYL)BIS(N-NITRO-, N,N'-(1,2-Ethanediyl)bis(N-nitro-beta-alanine), 4,7-dinitro-4,7-diazadecanedioic acid, 4-04-00-03418 (Beilstein Handbook Reference), N,N -(1,2-Ethanediyl)bis[N-nitro-beta-alanine]
Technical Specifications
| Molecular Formula | C8H14N4O8 |
| Molecular Weight | 294.08118 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 173.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.08118 Da |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
| SMILES | C(CN(CCN(CCC(=O)O)[N+](=O)[O-])[N+](=O)[O-])C(=O)O |
| InChIKey | GOFILDPHMQJATQ-UHFFFAOYSA-N |
Chemical Property Profile of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-
Property Insights of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-. The TPSA of 173.0 Ų indicates high polarity, suggesting beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-?
The CAS number of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- is 10526-63-3.
What is the molecular formula of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-?
The molecular formula of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- is C8H14N4O8.
What is the molecular weight of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-?
The molecular weight of beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- is 294.08118 g/mol.
Where can I buy beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-?
You can request a quote for beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-?
Yes, CoreyChem provides custom synthesis services for beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.