1-Propanol, 3-chloro-, phosphate (3:1)
TL;DR: 1-Propanol, 3-chloro-, phosphate (3:1) (CAS 1067-98-7) is a chemical compound with molecular formula C9H18Cl3O4P and molecular weight 326.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(3-chloropropyl) phosphate
Also Known As: Tris(3-chloropropyl) phosphate, Tri(chloropropyl) phosphate, Tris(chloropropyl)phosphate, TRIS(3-CHLOROPROPYL)PHOSPHATE, Tris(monochloropropyl) phosphate
| Molecular Formula | C9H18Cl3O4P |
|---|---|
| Molecular Weight | 326.00 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 326.00082 |
| Heavy Atoms | 17 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 1067-98-7 |
|---|---|
| SMILES | C(COP(=O)(OCCCCl)OCCCCl)CCl |
| InChIKey | WOURXYYHORRGQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanol, 3-chloro-, phosphate (3:1) (CAS 1067-98-7), with molecular formula C9H18Cl3O4P and molecular weight 326.00 g/mol. IUPAC: tris(3-chloropropyl) phosphate.
Chemical Property Profile of 1-Propanol, 3-chloro-, phosphate (3:1)
Property Insights of 1-Propanol, 3-chloro-, phosphate (3:1)
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanol, 3-chloro-, phosphate (3:1). With a topological polar surface area (TPSA) of 44.8 Ų, 1-Propanol, 3-chloro-, phosphate (3:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanol, 3-chloro-, phosphate (3:1) 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 1-Propanol, 3-chloro-, phosphate (3:1)?
The CAS number of 1-Propanol, 3-chloro-, phosphate (3:1) is 1067-98-7.
What is the molecular formula of 1-Propanol, 3-chloro-, phosphate (3:1)?
The molecular formula of 1-Propanol, 3-chloro-, phosphate (3:1) is C9H18Cl3O4P.
What is the molecular weight of 1-Propanol, 3-chloro-, phosphate (3:1)?
The molecular weight of 1-Propanol, 3-chloro-, phosphate (3:1) is 326.00 g/mol.
Where can I buy 1-Propanol, 3-chloro-, phosphate (3:1)?
You can request a quote for 1-Propanol, 3-chloro-, phosphate (3:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanol, 3-chloro-, phosphate (3:1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanol, 3-chloro-, phosphate (3:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.