(2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile
TL;DR: (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile (CAS 40755-07-5) is a chemical compound with molecular formula C14H14N2 and molecular weight 210.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)acetonitrile
Also Known As: 2,3,4,9-tetrahydro-1h-carbazol-3-ylacetonitrile, 2-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)acetonitrile, (2,3,4,9-TETRAHYDRO-1H-CARBAZOL-3-YL)-ACETONITRILE, (2,3,4,9-Tetrahydro-1H-carbazol-3-yl)acetonitrile, 684-418-4
| Molecular Formula | C14H14N2 |
|---|---|
| Molecular Weight | 210.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 39.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.11569 |
| Heavy Atoms | 16 |
| Complexity | 303.0 |
Chemical Identifiers
| CAS Number | 40755-07-5 |
|---|---|
| SMILES | C1CC2=C(CC1CC#N)C3=CC=CC=C3N2 |
| InChIKey | WCVKHIRZXGSZRF-UHFFFAOYSA-N |
Product Overview
(2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile (CAS 40755-07-5), with molecular formula C14H14N2 and molecular weight 210.12 g/mol. IUPAC: 2-(2,3,4,9-tetrahydro-1H-carbazol-3-yl)acetonitrile.
Chemical Property Profile of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile
Property Insights of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile. With a topological polar surface area (TPSA) of 39.6 Ų, (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile has 1 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 (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile?
The CAS number of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile is 40755-07-5.
What is the molecular formula of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile?
The molecular formula of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile is C14H14N2.
What is the molecular weight of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile?
The molecular weight of (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile is 210.12 g/mol.
Where can I buy (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile?
You can request a quote for (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for (2,3,4,9-Tetrahydro-1H-carbazol-3-YL)-acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.