2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-
TL;DR: 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- (CAS 38847-94-8) is a chemical compound with molecular formula C14H17NO4 and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-benzodioxol-5-yl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethanone
Also Known As: [1- -2-pyrrolidinyl]methanol|2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-|1-(1,3-Benzodioxol-5-ylacetyl)-2-pyrrolidinemethanol|[1-(1,3-Benzodioxol-5-ylacetyl)-2-pyrrolidinyl]methanol #|2-(1,3-benzodioxol-5-yl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethanone|2-(2H-1,3-benzodioxol-5-yl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one|PNCIDEZDEIELJG-UHFFFAOYSA-N
| Molecular Formula | C14H17NO4 |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 263.11575 |
| Heavy Atoms | 19 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 38847-94-8 |
|---|---|
| SMILES | C1CC(N(C1)C(=O)CC2=CC3=C(C=C2)OCO3)CO |
| InChIKey | PNCIDEZDEIELJG-UHFFFAOYSA-N |
Product Overview
2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- (CAS 38847-94-8), with molecular formula C14H17NO4 and molecular weight 263.12 g/mol. IUPAC: 2-(1,3-benzodioxol-5-yl)-1-[2-(hydroxymethyl)pyrrolidin-1-yl]ethanone.
Chemical Property Profile of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-
Property Insights of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-. With a topological polar surface area (TPSA) of 59.0 Ų, 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- has 1 hydrogen bond donor(s) and 4 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 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-?
The CAS number of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- is 38847-94-8.
What is the molecular formula of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-?
The molecular formula of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- is C14H17NO4.
What is the molecular weight of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-?
The molecular weight of 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- is 263.12 g/mol.
Where can I buy 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-?
You can request a quote for 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinemethanol, 1-(1,3-benzodioxol-5-ylacetyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.