2,4-Dimethylbenzylamine
TL;DR: 2,4-Dimethylbenzylamine (CAS 94-98-4) is a chemical compound with molecular formula C9H13N and molecular weight 135.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dimethylphenyl)methanamine
Also Known As: 2,4-Dimethylbenzylamine, (2,4-Dimethylphenyl)methanamine, Benzenemethanamine, 2,4-dimethyl-, 2,4-dimethylbenzenemethanamine, omega-amino-psi-cumene
| Molecular Formula | C9H13N |
|---|---|
| Molecular Weight | 135.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 135.1048 |
| Heavy Atoms | 10 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 94-98-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)CN)C |
| InChIKey | GBSUVYGVEQDZPG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4-Dimethylbenzylamine (CAS 94-98-4), with molecular formula C9H13N and molecular weight 135.10 g/mol. IUPAC: (2,4-dimethylphenyl)methanamine.
Chemical Property Profile of 2,4-Dimethylbenzylamine
Property Insights of 2,4-Dimethylbenzylamine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethylbenzylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 2,4-Dimethylbenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethylbenzylamine has 1 hydrogen bond donor(s) and 1 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 2,4-Dimethylbenzylamine?
The CAS number of 2,4-Dimethylbenzylamine is 94-98-4.
What is the molecular formula of 2,4-Dimethylbenzylamine?
The molecular formula of 2,4-Dimethylbenzylamine is C9H13N.
What is the molecular weight of 2,4-Dimethylbenzylamine?
The molecular weight of 2,4-Dimethylbenzylamine is 135.10 g/mol.
Where can I buy 2,4-Dimethylbenzylamine?
You can request a quote for 2,4-Dimethylbenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethylbenzylamine?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethylbenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.