(4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile
TL;DR: (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile (CAS 7331-78-4) is a chemical compound with molecular formula C21H14BrN and molecular weight 359.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-2-(9H-fluoren-9-yl)acetonitrile
Also Known As: (4-bromophenyl)(9h-fluoren-9-yl)acetonitrile, KST-1A2471, 2-(4-bromophenyl)-2-(9H-fluoren-9-yl)acetonitrile
| Molecular Formula | C21H14BrN |
|---|---|
| Molecular Weight | 359.03 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 359.03094 |
| Heavy Atoms | 23 |
| Complexity | 436.0 |
Chemical Identifiers
| CAS Number | 7331-78-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)C(C#N)C4=CC=C(C=C4)Br |
| InChIKey | MXRNQAKNDOXLOT-UHFFFAOYSA-N |
Product Overview
(4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile (CAS 7331-78-4), with molecular formula C21H14BrN and molecular weight 359.03 g/mol. IUPAC: 2-(4-bromophenyl)-2-(9H-fluoren-9-yl)acetonitrile.
Chemical Property Profile of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile
Property Insights of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile
The XLogP value of 5.4 indicates that (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile?
The CAS number of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile is 7331-78-4.
What is the molecular formula of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile?
The molecular formula of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile is C21H14BrN.
What is the molecular weight of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile?
The molecular weight of (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile is 359.03 g/mol.
Where can I buy (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile?
You can request a quote for (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)(9h-fluoren-9-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.