Phosphonic dichloride, (3-methyl-1,2-butadienyl)-
TL;DR: Phosphonic dichloride, (3-methyl-1,2-butadienyl)- (CAS 13337-33-2) is a chemical compound with molecular formula C5H7Cl2OP and molecular weight 183.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dichlorophosphoryl-3-methylbuta-1,2-diene
Also Known As: Phosphonic dichloride, (3-methyl-1,2-butadienyl)-, 1-dichlorophosphoryl-3-methylbuta-1,2-diene, 3-Methyl-1,2-butadienephosphonicdichloride, 3-methyl-1,2-butadienylphosphonic dichloride, 1,2-Butandienyl-1-methyl-phosphonic dichloride
| Molecular Formula | C5H7Cl2OP |
|---|---|
| Molecular Weight | 183.96 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 183.96115 |
| Heavy Atoms | 9 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 13337-33-2 |
|---|---|
| SMILES | CC(=C=CP(=O)(Cl)Cl)C |
| InChIKey | WBWKMWRLRXOVAW-UHFFFAOYSA-N |
Product Overview
Phosphonic dichloride, (3-methyl-1,2-butadienyl)- (CAS 13337-33-2), with molecular formula C5H7Cl2OP and molecular weight 183.96 g/mol. IUPAC: 1-dichlorophosphoryl-3-methylbuta-1,2-diene.
Chemical Property Profile of Phosphonic dichloride, (3-methyl-1,2-butadienyl)-
Property Insights of Phosphonic dichloride, (3-methyl-1,2-butadienyl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonic dichloride, (3-methyl-1,2-butadienyl)-. With a topological polar surface area (TPSA) of 17.1 Ų, Phosphonic dichloride, (3-methyl-1,2-butadienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonic dichloride, (3-methyl-1,2-butadienyl)- has 0 hydrogen bond donor(s) and 1 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 Phosphonic dichloride, (3-methyl-1,2-butadienyl)-?
The CAS number of Phosphonic dichloride, (3-methyl-1,2-butadienyl)- is 13337-33-2.
What is the molecular formula of Phosphonic dichloride, (3-methyl-1,2-butadienyl)-?
The molecular formula of Phosphonic dichloride, (3-methyl-1,2-butadienyl)- is C5H7Cl2OP.
What is the molecular weight of Phosphonic dichloride, (3-methyl-1,2-butadienyl)-?
The molecular weight of Phosphonic dichloride, (3-methyl-1,2-butadienyl)- is 183.96 g/mol.
Where can I buy Phosphonic dichloride, (3-methyl-1,2-butadienyl)-?
You can request a quote for Phosphonic dichloride, (3-methyl-1,2-butadienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic dichloride, (3-methyl-1,2-butadienyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic dichloride, (3-methyl-1,2-butadienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.