2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile
TL;DR: 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile (CAS 57411-92-4) 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-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile
Also Known As: 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile, (2,3,4,9-Tetrahydro-1H-carbazol-6-yl)acetonitrile
| Molecular Formula | C14H14N2 |
|---|---|
| Molecular Weight | 210.12 g/mol |
| LogP | 2.9 |
| 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 | 57411-92-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(N2)C=CC(=C3)CC#N |
| InChIKey | VGDFUNMBYWCUCB-UHFFFAOYSA-N |
Product Overview
2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile (CAS 57411-92-4), with molecular formula C14H14N2 and molecular weight 210.12 g/mol. IUPAC: 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile.
Chemical Property Profile of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile
Property Insights of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile. With a topological polar surface area (TPSA) of 39.6 Ų, 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(6,7,8,9-tetrahydro-5H-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-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile?
The CAS number of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile is 57411-92-4.
What is the molecular formula of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile?
The molecular formula of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile is C14H14N2.
What is the molecular weight of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile?
The molecular weight of 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile is 210.12 g/mol.
Where can I buy 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile?
You can request a quote for 2-(6,7,8,9-tetrahydro-5H-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-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.