1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate
TL;DR: 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate (CAS 25658-40-6) is a chemical compound with molecular formula C11H22N4O8S and molecular weight 370.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
carboxysulfanylformic acid;[2-(hydrazinecarbonyloxymethyl)-2-methylpentyl] N-aminocarbamate
Also Known As: 2-Methyl-2-propyl-1,3-propanediol dicarbazate, 7,12-Dihydroxy-7,12-dimethylbenz[a]anthracene, 2-Methyl-2-propyl-1,3-propanediol bis(aminocarbamate) hydrogen sulfate, 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate, thiodicarbonic acid- 2-{[(hydrazinylcarbonyl)oxy]methyl}-2-methylpentyl hydrazinecarboxylate(1:1)
| Molecular Formula | C11H22N4O8S |
|---|---|
| Molecular Weight | 370.12 g/mol |
| LogP | 1.07 |
| Topological Polar Surface Area | 229.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 370.11584 |
| Heavy Atoms | 24 |
| Complexity | 325.0 |
Chemical Identifiers
| CAS Number | 25658-40-6 |
|---|---|
| SMILES | CCCC(C)(COC(=O)NN)COC(=O)NN.C(=O)(O)SC(=O)O |
| InChIKey | JGDFQGIKVSGDAN-UHFFFAOYSA-N |
Product Overview
1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate (CAS 25658-40-6), with molecular formula C11H22N4O8S and molecular weight 370.12 g/mol. IUPAC: carboxysulfanylformic acid;[2-(hydrazinecarbonyloxymethyl)-2-methylpentyl] N-aminocarbamate.
Chemical Property Profile of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate
Property Insights of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate
The XLogP value of 1.07 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate. The TPSA of 229.0 Ų indicates high polarity, suggesting 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate?
The CAS number of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate is 25658-40-6.
What is the molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate?
The molecular formula of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate is C11H22N4O8S.
What is the molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate?
The molecular weight of 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate is 370.12 g/mol.
Where can I buy 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate?
You can request a quote for 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediol, 2-methyl-2-propyl-, bis(aminocarbamate), hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.