Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester
TL;DR: Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester (CAS 82682-93-7) is a chemical compound with molecular formula C7H12Br3O4P and molecular weight 427.80 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromoprop-2-enyl 2,3-dibromopropyl methyl phosphate
Also Known As: 2-Bromoallyl 2,3-dibromopropyl methylphosphate, Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester, (2-Bromoallyl)(2,3-dibromopropyl)methyl=phosphate, 2-bromoprop-2-en-1-yl 2,3-dibromopropyl methyl phosphate, 2-bromoprop-2-enyl 2,3-dibromopropyl methyl phosphate
| Molecular Formula | C7H12Br3O4P |
|---|---|
| Molecular Weight | 427.80 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 427.80234 |
| Heavy Atoms | 15 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 82682-93-7 |
|---|---|
| SMILES | COP(=O)(OCC(CBr)Br)OCC(=C)Br |
| InChIKey | VYTWZATYIPXWPF-UHFFFAOYSA-N |
Product Overview
Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester (CAS 82682-93-7), with molecular formula C7H12Br3O4P and molecular weight 427.80 g/mol. IUPAC: 2-bromoprop-2-enyl 2,3-dibromopropyl methyl phosphate.
Chemical Property Profile of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester
Property Insights of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester. With a topological polar surface area (TPSA) of 44.8 Ų, Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester has 0 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 Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester?
The CAS number of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester is 82682-93-7.
What is the molecular formula of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester?
The molecular formula of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester is C7H12Br3O4P.
What is the molecular weight of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester?
The molecular weight of Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester is 427.80 g/mol.
Where can I buy Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester?
You can request a quote for Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, 2-bromoallyl 2,3-dibromopropyl methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.