Methylbutyrimidate
TL;DR: Methylbutyrimidate (CAS 54942-33-5) is a chemical compound with molecular formula C5H11NO and molecular weight 101.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl butanimidate
Also Known As: Methylbutyrimidate, methyl butanimidate, methyl butyrimidate, Methylbutyrimidat, 1-Methoxy-1-butanimine
| Molecular Formula | C5H11NO |
|---|---|
| Molecular Weight | 101.08 g/mol |
| LogP | 1.41017 |
| Topological Polar Surface Area | 33.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 101.08406 |
| Heavy Atoms | 7 |
| Complexity | 61.100494 |
Chemical Identifiers
| CAS Number | 54942-33-5 |
|---|---|
| SMILES | CCCC(=N)OC |
Product Overview
Methylbutyrimidate (CAS 54942-33-5), with molecular formula C5H11NO and molecular weight 101.08 g/mol. IUPAC: methyl butanimidate.
Chemical Property Profile of Methylbutyrimidate
Property Insights of Methylbutyrimidate
The XLogP value of 1.41017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methylbutyrimidate. With a topological polar surface area (TPSA) of 33.08 Ų, Methylbutyrimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methylbutyrimidate has 1 hydrogen bond donor(s) and 2 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 Methylbutyrimidate?
The CAS number of Methylbutyrimidate is 54942-33-5.
What is the molecular formula of Methylbutyrimidate?
The molecular formula of Methylbutyrimidate is C5H11NO.
What is the molecular weight of Methylbutyrimidate?
The molecular weight of Methylbutyrimidate is 101.08 g/mol.
Where can I buy Methylbutyrimidate?
You can request a quote for Methylbutyrimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylbutyrimidate?
Yes, KEHONG BIO provides custom synthesis services for Methylbutyrimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.