N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline structure

N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline

TL;DR: N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline (CAS 412945-08-5) is a chemical compound with molecular formula C14H23BrNO3P and molecular weight 363.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline

Also Known As: bis(2-methylpropyl) (4-bromophenyl)phosphoramidate, N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline

CAS: 412945-08-5
Molecular Formula C14H23BrNO3P
Molecular Weight 363.06 g/mol
LogP 5.3143
Topological Polar Surface Area 47.56 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 8
Exact Mass 363.05988
Heavy Atoms 20
Complexity 432.23718

Chemical Identifiers

CAS Number 412945-08-5
SMILES CC(C)COP(=O)(NC1=CC=C(C=C1)Br)OCC(C)C

Product Overview

N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline (CAS 412945-08-5), with molecular formula C14H23BrNO3P and molecular weight 363.06 g/mol. IUPAC: N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline

XLogP
5.3143
TPSA (Topological Polar Surface Area)
47.56
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
3
Rotatable Bonds
8
Heavy Atoms
20
Complexity
432.23718
Exact Mass
363.05988
Monoisotopic Mass
363.05988
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline

The XLogP value of 5.3143 indicates that N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.56 Ų, N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline?

The CAS number of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline is 412945-08-5.

What is the molecular formula of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline?

The molecular formula of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline is C14H23BrNO3P.

What is the molecular weight of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline?

The molecular weight of N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline is 363.06 g/mol.

Where can I buy N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline?

You can request a quote for N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline?

Yes, KEHONG BIO provides custom synthesis services for N-[bis(2-methylpropoxy)phosphoryl]-4-bromoaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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