4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate
TL;DR: 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate (CAS 100347-64-6) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2-dimethyl-3H-1-benzofuran-4-yl) carbamate
Also Known As: 2,2-Dimethyl-2,3-dihydro-4-benzofuranyl carbamate, 4-BENZOFURANOL, 2,3-DIHYDRO-2,2-DIMETHYL-, CARBAMATE, (2,2-dimethyl-3H-1-benzofuran-4-yl) carbamate, 2,2-dimethyl-2,3-dihydro-1-benzofuran-4-yl carbamate, RefChem:290243
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 100347-64-6 |
|---|---|
| SMILES | CC1(CC2=C(O1)C=CC=C2OC(=O)N)C |
| InChIKey | QWMCXKPUWNTGIZ-UHFFFAOYSA-N |
Product Overview
4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate (CAS 100347-64-6), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: (2,2-dimethyl-3H-1-benzofuran-4-yl) carbamate.
Chemical Property Profile of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate
Property Insights of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate. Following Lipinski's Rule of Five, 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate has 1 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 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate?
The CAS number of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate is 100347-64-6.
What is the molecular formula of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate?
The molecular formula of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate is C11H13NO3.
What is the molecular weight of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate?
The molecular weight of 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate is 207.09 g/mol.
Where can I buy 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate?
You can request a quote for 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzofuranol, 2,3-dihydro-2,2-dimethyl-, carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.