Benzyl 3-(triphenylphosphoranyl)propylcarbamate
TL;DR: Benzyl 3-(triphenylphosphoranyl)propylcarbamate (CAS 693764-80-6) is a chemical compound with molecular formula C29H29NO2P+ and molecular weight 454.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triphenyl-[3-(phenylmethoxycarbonylamino)propyl]phosphanium
Also Known As: Benzyl 3-(triphenylphosphoranyl)propylcarbamate, 1-BENZYLOXYCARBONYL-3-PIPERIDINEMETHANOL, triphenyl-[3-(phenylmethoxycarbonylamino)propyl]phosphanium, 3-(benzyloxycarbonylamino)propyl-triphenyl-phosphonium, Triphenyl[3-[[(phenylmethoxy)carbonyl]amino]propyl]phosphonium
| Molecular Formula | C29H29NO2P+ |
|---|---|
| Molecular Weight | 454.19 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 454.1936 |
| Heavy Atoms | 33 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 693764-80-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4 |
| InChIKey | LDVRMOGNIYUVJI-UHFFFAOYSA-O |
Product Overview
Benzyl 3-(triphenylphosphoranyl)propylcarbamate (CAS 693764-80-6), with molecular formula C29H29NO2P+ and molecular weight 454.19 g/mol. IUPAC: triphenyl-[3-(phenylmethoxycarbonylamino)propyl]phosphanium.
Chemical Property Profile of Benzyl 3-(triphenylphosphoranyl)propylcarbamate
Property Insights of Benzyl 3-(triphenylphosphoranyl)propylcarbamate
The XLogP value of 6.2 indicates that Benzyl 3-(triphenylphosphoranyl)propylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Benzyl 3-(triphenylphosphoranyl)propylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl 3-(triphenylphosphoranyl)propylcarbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzyl 3-(triphenylphosphoranyl)propylcarbamate?
The CAS number of Benzyl 3-(triphenylphosphoranyl)propylcarbamate is 693764-80-6.
What is the molecular formula of Benzyl 3-(triphenylphosphoranyl)propylcarbamate?
The molecular formula of Benzyl 3-(triphenylphosphoranyl)propylcarbamate is C29H29NO2P+.
What is the molecular weight of Benzyl 3-(triphenylphosphoranyl)propylcarbamate?
The molecular weight of Benzyl 3-(triphenylphosphoranyl)propylcarbamate is 454.19 g/mol.
Where can I buy Benzyl 3-(triphenylphosphoranyl)propylcarbamate?
You can request a quote for Benzyl 3-(triphenylphosphoranyl)propylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 3-(triphenylphosphoranyl)propylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 3-(triphenylphosphoranyl)propylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.