2,2-Dimethylpropane-1,3-diyl bis(chloroformate)
TL;DR: 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) (CAS 6892-17-7) is a chemical compound with molecular formula C7H10Cl2O4 and molecular weight 228.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-carbonochloridoyloxy-2,2-dimethylpropyl) carbonochloridate
Also Known As: 2,2-Dimethylpropane-1,3-diyl bis(chloroformate), 2,2-dimethylpropane-1,3-diylbis, 2,2-dimethylpropane-1,3-diyl dicarbonochloridate, (3-carbonochloridoyloxy-2,2-dimethylpropyl) carbonochloridate, Bis(chloroformic acid)2,2-dimethyl-1,3-propanediyl ester
| Molecular Formula | C7H10Cl2O4 |
|---|---|
| Molecular Weight | 228.00 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 227.99562 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 6892-17-7 |
|---|---|
| SMILES | CC(C)(COC(=O)Cl)COC(=O)Cl |
| InChIKey | ROPHHOGKCLJYID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethylpropane-1,3-diyl bis(chloroformate) (CAS 6892-17-7), with molecular formula C7H10Cl2O4 and molecular weight 228.00 g/mol. IUPAC: (3-carbonochloridoyloxy-2,2-dimethylpropyl) carbonochloridate.
Chemical Property Profile of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)
Property Insights of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)
The XLogP value of 3.3 indicates that 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) has 0 hydrogen bond donor(s) and 4 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-Dimethylpropane-1,3-diyl bis(chloroformate)?
The CAS number of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) is 6892-17-7.
What is the molecular formula of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)?
The molecular formula of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) is C7H10Cl2O4.
What is the molecular weight of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)?
The molecular weight of 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) is 228.00 g/mol.
Where can I buy 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)?
You can request a quote for 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethylpropane-1,3-diyl bis(chloroformate)?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethylpropane-1,3-diyl bis(chloroformate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.