3-Butenyl, 2-methyl-
TL;DR: 3-Butenyl, 2-methyl- (CAS 52898-42-7) is a chemical compound with molecular formula C5H9 and molecular weight 69.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Also Known As: 3-Butenyl, 2-methyl-, 2-methyl-3-butenyl, 3-Methylbut-1-ene, 2-methylbut-3-en-1-yl, 3-methylbut-1-en-4-yl
| Molecular Formula | C5H9 |
|---|---|
| Molecular Weight | 69.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 69.07043 |
| Heavy Atoms | 5 |
| Complexity | 29.0 |
Chemical Identifiers
| CAS Number | 52898-42-7 |
|---|---|
| SMILES | CC([CH2])C=C |
| InChIKey | VLBIFNCUKNKYMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Butenyl, 2-methyl- (CAS 52898-42-7), with molecular formula C5H9 and molecular weight 69.07 g/mol.
Chemical Property Profile of 3-Butenyl, 2-methyl-
Property Insights of 3-Butenyl, 2-methyl-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Butenyl, 2-methyl-. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Butenyl, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Butenyl, 2-methyl- has 0 hydrogen bond donor(s) and 0 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 3-Butenyl, 2-methyl-?
The CAS number of 3-Butenyl, 2-methyl- is 52898-42-7.
What is the molecular formula of 3-Butenyl, 2-methyl-?
The molecular formula of 3-Butenyl, 2-methyl- is C5H9.
What is the molecular weight of 3-Butenyl, 2-methyl-?
The molecular weight of 3-Butenyl, 2-methyl- is 69.07 g/mol.
Where can I buy 3-Butenyl, 2-methyl-?
You can request a quote for 3-Butenyl, 2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Butenyl, 2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Butenyl, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.