2,3-二甲基-1,3-丁二烯
TL;DR: 2,3-二甲基-1,3-丁二烯 (CAS 513-81-5) is a chemical compound with molecular formula C6H10 and molecular weight 82.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-二甲基-1,3-丁二烯
2,3-dimethylbuta-1,3-diene
Also Known As: 2,3-DIMETHYL-1,3-BUTADIENE, Biisopropenyl, Diisopropenyl, 2,3-Dimethylbuta-1,3-diene, 2,3-Dimethylbutadiene
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 82.07825 |
| Heavy Atoms | 6 |
| Complexity | 66.0 |
| Vapor Pressure | 152.0 [mmHg] |
Chemical Identifiers
| CAS Number | 513-81-5 |
|---|---|
| SMILES | CC(=C)C(=C)C |
| InChIKey | SDJHPPZKZZWAKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-二甲基-1,3-丁二烯 (CAS 513-81-5), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: 2,3-dimethylbuta-1,3-diene.
Chemical Property Profile of 2,3-二甲基-1,3-丁二烯
Property Insights of 2,3-二甲基-1,3-丁二烯
The XLogP value of 3.1 indicates that 2,3-二甲基-1,3-丁二烯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3-二甲基-1,3-丁二烯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-二甲基-1,3-丁二烯 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 2,3-二甲基-1,3-丁二烯?
The CAS number of 2,3-二甲基-1,3-丁二烯 is 513-81-5.
What is the molecular formula of 2,3-二甲基-1,3-丁二烯?
The molecular formula of 2,3-二甲基-1,3-丁二烯 is C6H10.
What is the molecular weight of 2,3-二甲基-1,3-丁二烯?
The molecular weight of 2,3-二甲基-1,3-丁二烯 is 82.08 g/mol.
Where can I buy 2,3-二甲基-1,3-丁二烯?
You can request a quote for 2,3-二甲基-1,3-丁二烯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-二甲基-1,3-丁二烯?
Yes, KEHONG BIO provides custom synthesis services for 2,3-二甲基-1,3-丁二烯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.