2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate
TL;DR: 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate (CAS 30692-70-7) is a chemical compound with molecular formula C10H21NO3 and molecular weight 203.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(hydroxymethyl)-2-methylpentyl] N-ethylcarbamate
Also Known As: 2-(hydroxymethyl)-2-methylpentyl ethylcarbamate, Ethylcarbamic acid 2-(hydroxymethyl)-2-methylpentyl ester, [2-(hydroxymethyl)-2-methylpentyl] N-ethylcarbamate, Carbamic acid, ethyl-, 2-(hydroxymethyl)-2-methylpentyl ester, 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate
| Molecular Formula | C10H21NO3 |
|---|---|
| Molecular Weight | 203.15 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 203.15215 |
| Heavy Atoms | 14 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 30692-70-7 |
|---|---|
| SMILES | CCCC(C)(CO)COC(=O)NCC |
| InChIKey | MZCKIUBNVPGFPZ-UHFFFAOYSA-N |
Product Overview
2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate (CAS 30692-70-7), with molecular formula C10H21NO3 and molecular weight 203.15 g/mol. IUPAC: [2-(hydroxymethyl)-2-methylpentyl] N-ethylcarbamate.
Chemical Property Profile of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate
Property Insights of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate. With a topological polar surface area (TPSA) of 58.6 Ų, 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate has 2 hydrogen bond donor(s) and 3 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-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate?
The CAS number of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate is 30692-70-7.
What is the molecular formula of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate?
The molecular formula of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate is C10H21NO3.
What is the molecular weight of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate?
The molecular weight of 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate is 203.15 g/mol.
Where can I buy 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate?
You can request a quote for 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hydroxymethyl)-2-methylpentyl hydrogen ethylcarbonimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.