2,2-Propanediol, 1,3-dichloro-
TL;DR: 2,2-Propanediol, 1,3-dichloro- (CAS 82598-72-9) is a chemical compound with molecular formula C3H6Cl2O2 and molecular weight 143.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloropropane-2,2-diol
Also Known As: 2,2-Propanediol, 1,3-dichloro-, 1,3-dichloropropane-2,2-diol, 1,3-Dichloro-propane-2,2-diol
| Molecular Formula | C3H6Cl2O2 |
|---|---|
| Molecular Weight | 143.97 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 143.97449 |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 82598-72-9 |
|---|---|
| SMILES | C(C(CCl)(O)O)Cl |
| InChIKey | BJCFYPFSEIJWLQ-UHFFFAOYSA-N |
Product Overview
2,2-Propanediol, 1,3-dichloro- (CAS 82598-72-9), with molecular formula C3H6Cl2O2 and molecular weight 143.97 g/mol. IUPAC: 1,3-dichloropropane-2,2-diol.
Chemical Property Profile of 2,2-Propanediol, 1,3-dichloro-
Property Insights of 2,2-Propanediol, 1,3-dichloro-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Propanediol, 1,3-dichloro-. With a topological polar surface area (TPSA) of 40.5 Ų, 2,2-Propanediol, 1,3-dichloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Propanediol, 1,3-dichloro- has 2 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-Propanediol, 1,3-dichloro-?
The CAS number of 2,2-Propanediol, 1,3-dichloro- is 82598-72-9.
What is the molecular formula of 2,2-Propanediol, 1,3-dichloro-?
The molecular formula of 2,2-Propanediol, 1,3-dichloro- is C3H6Cl2O2.
What is the molecular weight of 2,2-Propanediol, 1,3-dichloro-?
The molecular weight of 2,2-Propanediol, 1,3-dichloro- is 143.97 g/mol.
Where can I buy 2,2-Propanediol, 1,3-dichloro-?
You can request a quote for 2,2-Propanediol, 1,3-dichloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Propanediol, 1,3-dichloro-?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Propanediol, 1,3-dichloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.