(3R)-4-chloro-3-hydroxybutanenitrile
TL;DR: (3R)-4-chloro-3-hydroxybutanenitrile (CAS 84369-69-7) is a chemical compound with molecular formula C4H6ClNO and molecular weight 119.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-4-chloro-3-hydroxybutanenitrile
Also Known As: (R)-4-Chloro-3-hydroxybutyronitrile, (R)-4-chloro-3-hydroxybutanenitrile, (R)-(+)-4-Chloro-3-hydroxybutyronitrile, (3R)-4-chloro-3-hydroxybutanenitrile, Levocarnitine Impurity 18
| Molecular Formula | C4H6ClNO |
|---|---|
| Molecular Weight | 119.01 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 44.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 119.013794 |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
Chemical Identifiers
| CAS Number | 84369-69-7 |
|---|---|
| SMILES | C(C#N)[C@H](CCl)O |
| InChIKey | LHBPNZDUNCZWFL-SCSAIBSYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3R)-4-chloro-3-hydroxybutanenitrile (CAS 84369-69-7), with molecular formula C4H6ClNO and molecular weight 119.01 g/mol. IUPAC: (3R)-4-chloro-3-hydroxybutanenitrile.
Chemical Property Profile of (3R)-4-chloro-3-hydroxybutanenitrile
Property Insights of (3R)-4-chloro-3-hydroxybutanenitrile
The XLogP value of -0.1 indicates that (3R)-4-chloro-3-hydroxybutanenitrile is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.0 Ų, (3R)-4-chloro-3-hydroxybutanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3R)-4-chloro-3-hydroxybutanenitrile 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 (3R)-4-chloro-3-hydroxybutanenitrile?
The CAS number of (3R)-4-chloro-3-hydroxybutanenitrile is 84369-69-7.
What is the molecular formula of (3R)-4-chloro-3-hydroxybutanenitrile?
The molecular formula of (3R)-4-chloro-3-hydroxybutanenitrile is C4H6ClNO.
What is the molecular weight of (3R)-4-chloro-3-hydroxybutanenitrile?
The molecular weight of (3R)-4-chloro-3-hydroxybutanenitrile is 119.01 g/mol.
Where can I buy (3R)-4-chloro-3-hydroxybutanenitrile?
You can request a quote for (3R)-4-chloro-3-hydroxybutanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R)-4-chloro-3-hydroxybutanenitrile?
Yes, KEHONG BIO provides custom synthesis services for (3R)-4-chloro-3-hydroxybutanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.