![(2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile structure](/static/products/2814/28144-18-5.webp)
(2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile
TL;DR: (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile (CAS 28144-18-5) is a chemical compound with molecular formula C11H13N and molecular weight 159.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-prop-2-enylbicyclo[2.2.1]hept-5-ene-2-carbonitrile
Also Known As: KST-1A3946, (2s)-2-(prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile, (2S)-2-prop-2-enylbicyclo[2.2.1]hept-5-ene-2-carbonitrile, (5S)-5-prop-2-enylbicyclo[2.2.1]hept-2-ene-5-carbonitrile, 2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile
| Molecular Formula | C11H13N |
|---|---|
| Molecular Weight | 159.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.1048 |
| Heavy Atoms | 12 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 28144-18-5 |
|---|---|
| SMILES | C=CC[C@@]1(CC2CC1C=C2)C#N |
| InChIKey | NIIOXSCKCHMHFA-VQXHTEKXSA-N |
Product Overview
(2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile (CAS 28144-18-5), with molecular formula C11H13N and molecular weight 159.10 g/mol. IUPAC: (2S)-2-prop-2-enylbicyclo[2.2.1]hept-5-ene-2-carbonitrile.
Chemical Property Profile of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile
Property Insights of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile. With a topological polar surface area (TPSA) of 23.8 Ų, (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile has 0 hydrogen bond donor(s) and 1 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 (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile?
The CAS number of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile is 28144-18-5.
What is the molecular formula of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile?
The molecular formula of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile is C11H13N.
What is the molecular weight of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile?
The molecular weight of (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile is 159.10 g/mol.
Where can I buy (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile?
You can request a quote for (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for (2s)-2-(Prop-2-en-1-yl)bicyclo[2.2.1]hept-5-ene-2-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.