4-二甲氨基甲酰苄醇
TL;DR: 4-二甲氨基甲酰苄醇 (CAS 6638-22-8) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-二甲氨基甲酰苄醇
4-(hydroxymethyl)-N,N-dimethylbenzamide
Also Known As: 4-(hydroxymethyl)-n,n-dimethylbenzamide, 4-Dimethylcarbamoylbenzyl alcohol, Benzamide, 4-(hydroxymethyl)-N,N-dimethyl-, 4-(hydroxymethyl)-N,N-dimethyl-benzamide, RefChem:98778
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 6638-22-8 |
|---|---|
| SMILES | CN(C)C(=O)C1=CC=C(C=C1)CO |
| InChIKey | SIDFORUPYBJQFI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-二甲氨基甲酰苄醇 (CAS 6638-22-8), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: 4-(hydroxymethyl)-N,N-dimethylbenzamide.
Chemical Property Profile of 4-二甲氨基甲酰苄醇
Property Insights of 4-二甲氨基甲酰苄醇
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-二甲氨基甲酰苄醇. With a topological polar surface area (TPSA) of 40.5 Ų, 4-二甲氨基甲酰苄醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-二甲氨基甲酰苄醇 has 1 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 4-二甲氨基甲酰苄醇?
The CAS number of 4-二甲氨基甲酰苄醇 is 6638-22-8.
What is the molecular formula of 4-二甲氨基甲酰苄醇?
The molecular formula of 4-二甲氨基甲酰苄醇 is C10H13NO2.
What is the molecular weight of 4-二甲氨基甲酰苄醇?
The molecular weight of 4-二甲氨基甲酰苄醇 is 179.09 g/mol.
Where can I buy 4-二甲氨基甲酰苄醇?
You can request a quote for 4-二甲氨基甲酰苄醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-二甲氨基甲酰苄醇?
Yes, KEHONG BIO provides custom synthesis services for 4-二甲氨基甲酰苄醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.