{2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile
TL;DR: {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile (CAS 375350-83-7) is a chemical compound with molecular formula C17H19NO and molecular weight 253.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2,2-dimethyl-3-[(E)-3-phenylprop-2-enoyl]cyclobutyl]acetonitrile
Also Known As: (E)-2-(3-cinnamoyl-2,2-dimethylcyclobutyl)acetonitrile, {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile, 2-[2,2-dimethyl-3-[(E)-3-phenylprop-2-enoyl]cyclobutyl]acetonitrile
| Molecular Formula | C17H19NO |
|---|---|
| Molecular Weight | 253.15 g/mol |
| LogP | 3.84488 |
| Topological Polar Surface Area | 40.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.14667 |
| Heavy Atoms | 19 |
| Complexity | 521.9431 |
Chemical Identifiers
| CAS Number | 375350-83-7 |
|---|---|
| SMILES | CC1(C(CC1C(=O)/C=C/C2=CC=CC=C2)CC#N)C |
Product Overview
{2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile (CAS 375350-83-7), with molecular formula C17H19NO and molecular weight 253.15 g/mol. IUPAC: 2-[2,2-dimethyl-3-[(E)-3-phenylprop-2-enoyl]cyclobutyl]acetonitrile.
Chemical Property Profile of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile
Property Insights of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile
The XLogP value of 3.84488 indicates that {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.86 Ų, {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile has 0 hydrogen bond donor(s) and 2 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 {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile?
The CAS number of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile is 375350-83-7.
What is the molecular formula of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile?
The molecular formula of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile is C17H19NO.
What is the molecular weight of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile?
The molecular weight of {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile is 253.15 g/mol.
Where can I buy {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile?
You can request a quote for {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for {2,2-dimethyl-3-[(2E)-3-phenylprop-2-enoyl]cyclobutyl}acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.