2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-
TL;DR: 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- (CAS 14332-17-3) is a chemical compound with molecular formula C12H17NO8 and molecular weight 303.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
Also Known As: Gynocardin, KCS-5CA, KST-1B0499, 1-(hexopyranosyloxy)-4,5-dihydroxycyclopent-2-ene-1-carbonitrile, 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-
| Molecular Formula | C12H17NO8 |
|---|---|
| Molecular Weight | 303.10 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 303.09543 |
| Heavy Atoms | 21 |
| Complexity | 461.0 |
| Melting Point | 165 - 166 °C |
Chemical Identifiers
| CAS Number | 14332-17-3 |
|---|---|
| SMILES | C1=CC(C(C1O)O)(C#N)OC2C(C(C(C(O2)CO)O)O)O |
| InChIKey | HASDUOHKNMHNJA-UHFFFAOYSA-N |
Product Overview
2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- (CAS 14332-17-3), with molecular formula C12H17NO8 and molecular weight 303.10 g/mol. IUPAC: 4,5-dihydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile.
Chemical Property Profile of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-
Property Insights of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-
The XLogP value of -2.7 indicates that 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 164.0 Ų indicates high polarity, suggesting 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-?
The CAS number of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- is 14332-17-3.
What is the molecular formula of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-?
The molecular formula of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- is C12H17NO8.
What is the molecular weight of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-?
The molecular weight of 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- is 303.10 g/mol.
Where can I buy 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-?
You can request a quote for 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclopentene-1-carbonitrile, 1-(hexopyranosyloxy)-4,5-dihydroxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.