4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)
TL;DR: 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) (CAS 79456-25-0) is a chemical compound with molecular formula C23H31NO10 and molecular weight 481.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis((E)-but-2-enedioic acid);1-(4-methoxyphenyl)-3-piperidin-4-ylpropan-1-ol
Also Known As: 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt), alpha-(4-Methoxyphenyl)-4-piperidinepropanol (E)-2-butenedioate (1:2) (salt), (Methoxy-4 phenyl)-1 (piperidyl-4)-3 propanol-1 fumarate, (Methoxy-4 phenyl)-1 (piperidyl-4)-3 propanol-1 fumarate [French], (E)-but-2-enedioic acid; 1-(4-methoxyphenyl)-3-piperidin-4-ylpropan-1-ol
| Molecular Formula | C23H31NO10 |
|---|---|
| Molecular Weight | 481.19 g/mol |
| LogP | 1.932 |
| Topological Polar Surface Area | 190.69 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 481.1948 |
| Heavy Atoms | 34 |
| Complexity | 760.65753 |
Chemical Identifiers
| CAS Number | 79456-25-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(O)CCC2CCNCC2.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) (CAS 79456-25-0), with molecular formula C23H31NO10 and molecular weight 481.19 g/mol. IUPAC: bis((E)-but-2-enedioic acid);1-(4-methoxyphenyl)-3-piperidin-4-ylpropan-1-ol.
Chemical Property Profile of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)
Property Insights of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)
The XLogP value of 1.932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt). The TPSA of 190.69 Ų indicates high polarity, suggesting 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)?
The CAS number of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) is 79456-25-0.
What is the molecular formula of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)?
The molecular formula of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) is C23H31NO10.
What is the molecular weight of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)?
The molecular weight of 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) is 481.19 g/mol.
Where can I buy 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)?
You can request a quote for 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt)?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinepropanol, alpha-(4-methoxyphenyl)-, (E)-2-butenedioate (1:2) (salt) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.