2,2-二氯丙酸
TL;DR: 2,2-二氯丙酸 (CAS 75-99-0) is a chemical compound with molecular formula C3H4Cl2O2 and molecular weight 141.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-二氯丙酸
2,2-dichloropropanoic acid
Also Known As: DALAPON, 2,2-Dichloropropionic acid, Kenapon, Proprop, Alatex
| Molecular Formula | C3H4Cl2O2 |
|---|---|
| Molecular Weight | 141.96 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.95883 |
| Heavy Atoms | 7 |
| Complexity | 88.0 |
| Melting Point | 7.8 °C |
| Boiling Point | 190.0 °C at 760 mmHg |
| Density | 1.4 |
| Solubility | 50 % (NIOSH, 2024) |
| Vapor Pressure | 5.07 mmHg at 71.1 °C |
| Refractive Index | 1.4551 @ 20 °C |
Chemical Identifiers
| CAS Number | 75-99-0 |
|---|---|
| SMILES | CC(C(=O)O)(Cl)Cl |
| InChIKey | NDUPDOJHUQKPAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-二氯丙酸 (CAS 75-99-0), with molecular formula C3H4Cl2O2 and molecular weight 141.96 g/mol. IUPAC: 2,2-dichloropropanoic acid.
Chemical Property Profile of 2,2-二氯丙酸
Property Insights of 2,2-二氯丙酸
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-二氯丙酸. With a topological polar surface area (TPSA) of 37.3 Ų, 2,2-二氯丙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-二氯丙酸 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 2,2-二氯丙酸?
The CAS number of 2,2-二氯丙酸 is 75-99-0.
What is the molecular formula of 2,2-二氯丙酸?
The molecular formula of 2,2-二氯丙酸 is C3H4Cl2O2.
What is the molecular weight of 2,2-二氯丙酸?
The molecular weight of 2,2-二氯丙酸 is 141.96 g/mol.
Where can I buy 2,2-二氯丙酸?
You can request a quote for 2,2-二氯丙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-二氯丙酸?
Yes, KEHONG BIO provides custom synthesis services for 2,2-二氯丙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.