2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)
TL;DR: 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) (CAS 7599-06-6) is a chemical compound with molecular formula C16H22N2O11 and molecular weight 418.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-benzimidazol-2-yl)pentane-1,2,3,4,5-pentol;2,3-dihydroxybutanedioic acid
Also Known As: 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1), 1-(1H-benzimidazol-2-yl)pentane-1,2,3,4,5-pentol; 2,3-dihydroxybutanedioic acid, 2,3-Dihydroxybutanedioic acid--1-C-(1H-1,3-benzimidazol-2-yl)pentitol (1/1)
| Molecular Formula | C16H22N2O11 |
|---|---|
| Molecular Weight | 418.12 g/mol |
| LogP | -3.4513 |
| Topological Polar Surface Area | 245.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 418.12234 |
| Heavy Atoms | 29 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 7599-06-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)C(C(C(C(CO)O)O)O)O.C(C(C(=O)O)O)(C(=O)O)O |
| InChIKey | XECXCZLGHKFIDA-UHFFFAOYSA-N |
Product Overview
2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) (CAS 7599-06-6), with molecular formula C16H22N2O11 and molecular weight 418.12 g/mol. IUPAC: 1-(1H-benzimidazol-2-yl)pentane-1,2,3,4,5-pentol;2,3-dihydroxybutanedioic acid.
Chemical Property Profile of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)
Property Insights of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)
The XLogP value of -3.4513 indicates that 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 245.0 Ų indicates high polarity, suggesting 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) has 10 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)?
The CAS number of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) is 7599-06-6.
What is the molecular formula of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)?
The molecular formula of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) is C16H22N2O11.
What is the molecular weight of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)?
The molecular weight of 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) is 418.12 g/mol.
Where can I buy 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)?
You can request a quote for 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydroxybutanedioic acid--1-C-1H-benzimidazol-2-ylpentitol (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.