3,3,3-Tribromo-2-hydroxypropanenitrile
TL;DR: 3,3,3-Tribromo-2-hydroxypropanenitrile (CAS 74592-78-2) is a chemical compound with molecular formula C3H2Br3NO and molecular weight 304.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3,3-tribromo-2-hydroxypropanenitrile
Also Known As: 3,3,3-tribromo-2-hydroxypropanenitrile, 3,3,-TRIBROMO-2-HYDROXYPROPANONITRILE
| Molecular Formula | C3H2Br3NO |
|---|---|
| Molecular Weight | 304.77 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 304.76865 |
| Heavy Atoms | 8 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 74592-78-2 |
|---|---|
| SMILES | C(#N)C(C(Br)(Br)Br)O |
| InChIKey | YRVKHDJXSXWQKB-UHFFFAOYSA-N |
Product Overview
3,3,3-Tribromo-2-hydroxypropanenitrile (CAS 74592-78-2), with molecular formula C3H2Br3NO and molecular weight 304.77 g/mol. IUPAC: 3,3,3-tribromo-2-hydroxypropanenitrile.
Chemical Property Profile of 3,3,3-Tribromo-2-hydroxypropanenitrile
Property Insights of 3,3,3-Tribromo-2-hydroxypropanenitrile
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3,3-Tribromo-2-hydroxypropanenitrile. With a topological polar surface area (TPSA) of 44.0 Ų, 3,3,3-Tribromo-2-hydroxypropanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3,3-Tribromo-2-hydroxypropanenitrile has 1 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 3,3,3-Tribromo-2-hydroxypropanenitrile?
The CAS number of 3,3,3-Tribromo-2-hydroxypropanenitrile is 74592-78-2.
What is the molecular formula of 3,3,3-Tribromo-2-hydroxypropanenitrile?
The molecular formula of 3,3,3-Tribromo-2-hydroxypropanenitrile is C3H2Br3NO.
What is the molecular weight of 3,3,3-Tribromo-2-hydroxypropanenitrile?
The molecular weight of 3,3,3-Tribromo-2-hydroxypropanenitrile is 304.77 g/mol.
Where can I buy 3,3,3-Tribromo-2-hydroxypropanenitrile?
You can request a quote for 3,3,3-Tribromo-2-hydroxypropanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3,3-Tribromo-2-hydroxypropanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3,3,3-Tribromo-2-hydroxypropanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.